7VS
(4E)-4-hydrazinylidene-1,4-dihydroquinoline
Created: | 2016-12-08 |
Last modified: | 2017-02-01 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 21 |
Chiral Atom Count | 0 |
Bond Count | 22 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | (4E)-4-hydrazinylidene-1,4-dihydroquinoline |
Systematic Name (OpenEye OEToolkits) | (~{E})-1~{H}-quinolin-4-ylidenediazane |
Formula | C9 H9 N3 |
Molecular Weight | 159.188 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N\N=C1\c2c(NC=C1)cccc2 |
SMILES | CACTVS | 3.385 | NN=C1C=CNc2ccccc12 |
SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)C(=NN)C=CN2 |
Canonical SMILES | CACTVS | 3.385 | N\N=C1/C=CNc2ccccc12 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)/C(=N/N)/C=CN2 |
InChI | InChI | 1.03 | InChI=1S/C9H9N3/c10-12-9-5-6-11-8-4-2-1-3-7(8)9/h1-6H,10H2,(H,11,12) |
InChIKey | InChI | 1.03 | MYGFXCLXHGITIQ-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 7020411 |