4-[2-(3-azanyl-5-azanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzoic acid

Systemtic Name: 4-[2-(3-azanyl-5-azanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzoic acid Openeye Name: 4-[2-(3-amino-5-imino-1-phenyl-pyrazol-4-ylidene)hydrazino]benzoic acid CAS Name: 4-[2-(3-amino-5-imino-1-phenyl-4-pyrazolylidene)hydrazinyl]benzoic acid IUPAC Name: 4-[2-(3-amino-5-imino-1-phenylpyrazol-4-ylidene)hydrazinyl]benzoic acid Traditional Name: 4-[N'-(3-amino-5-imino-1-phenyl-2-pyrazolin-4-ylidene)hydrazino]benzoic acid Formula: C16H14N6O2 MolecularWeight: 322.32136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=N)C(=NNC3=CC=C(C=C3)C(=O)O)C(=N2)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=N)C(=NNC3=CC=C(C=C3)C(=O)O)C(=N2)N

InChI

InChI=1S/C16H14N6O2/c17-14-13(15(18)22(21-14)12-4-2-1-3-5-12)20-19-11-8-6-10(7-9-11)16(23)24/h1-9,18-19H,(H2,17,21)(H,23,24)