3-[(2E)-2-(3-chloranyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoic acid

Systemtic Name: 3-[(2E)-2-(3-chloranyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoic acid Openeye Name: 3-[(2E)-2-(3-chloro-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]benzoic acid CAS Name: 3-[(2E)-2-(3-chloro-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]benzoic acid IUPAC Name: 3-[(2E)-2-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzoic acid Traditional Name: 3-[(N'E)-N'-(3-chloro-4-keto-cyclohexa-2,5-dien-1-ylidene)hydrazino]benzoic acid Formula: C13H9ClN2O3 MolecularWeight: 276.67516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NN=C2C=CC(=O)C(=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N/N=C/2\C=CC(=O)C(=C2)Cl)C(=O)O

InChI

InChI=1S/C13H9ClN2O3/c14-11-7-10(4-5-12(11)17)16-15-9-3-1-2-8(6-9)13(18)19/h1-7,15H,(H,18,19)/b16-10+