ES8
[(9H-fluoren-9-ylideneamino)oxy]acetic acid
Created: | 2014-06-12 |
Last modified: | 2015-06-24 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 30 |
Chiral Atom Count | 0 |
Bond Count | 32 |
Aromatic Bond Count | 12 |
Chemical Component Summary | |
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Name | [(9H-fluoren-9-ylideneamino)oxy]acetic acid |
Systematic Name (OpenEye OEToolkits) | 2-(fluoren-9-ylideneamino)oxyethanoic acid |
Formula | C15 H11 N O3 |
Molecular Weight | 253.253 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)CO\N=C3/c1ccccc1c2c3cccc2 |
SMILES | CACTVS | 3.385 | OC(=O)CON=C1c2ccccc2c3ccccc13 |
SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc2c(c1)-c3ccccc3C2=NOCC(=O)O |
Canonical SMILES | CACTVS | 3.385 | OC(=O)CON=C1c2ccccc2c3ccccc13 |
Canonical SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc2c(c1)-c3ccccc3C2=NOCC(=O)O |
InChI | InChI | 1.03 | InChI=1S/C15H11NO3/c17-14(18)9-19-16-15-12-7-3-1-5-10(12)11-6-2-4-8-13(11)15/h1-8H,9H2,(H,17,18) |
InChIKey | InChI | 1.03 | PLACMAVVPYGZGF-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 4830481 |