HAO
{[3-(hydrazinocarbonyl)-4-methoxyphenyl]amino}(oxo)acetic acid
Created: | 2010-07-01 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 29 |
Chiral Atom Count | 0 |
Bond Count | 29 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | {[3-(hydrazinocarbonyl)-4-methoxyphenyl]amino}(oxo)acetic acid |
Systematic Name (OpenEye OEToolkits) | 2-[[3-(aminocarbamoyl)-4-methoxy-phenyl]amino]-2-oxidanylidene-ethanoic acid |
Formula | C10 H11 N3 O5 |
Molecular Weight | 253.211 |
Type | PEPTIDE-LIKE |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(=O)Nc1ccc(OC)c(C(=O)NN)c1 |
SMILES | CACTVS | 3.370 | COc1ccc(NC(=O)C(O)=O)cc1C(=O)NN |
SMILES | OpenEye OEToolkits | 1.7.6 | COc1ccc(cc1C(=O)NN)NC(=O)C(=O)O |
Canonical SMILES | CACTVS | 3.370 | COc1ccc(NC(=O)C(O)=O)cc1C(=O)NN |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | COc1ccc(cc1C(=O)NN)NC(=O)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C10H11N3O5/c1-18-7-3-2-5(12-9(15)10(16)17)4-6(7)8(14)13-11/h2-4H,11H2,1H3,(H,12,15)(H,13,14)(H,16,17) |
InChIKey | InChI | 1.03 | GRLLMVZTTMERGI-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 49867081 |