5-azanyl-3-[1-cyano-2-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylidene]-2-phenyl-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[1-cyano-2-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylidene]-2-phenyl-1H-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[1-cyano-2-(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylidene]-2-phenyl-1H-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[1-cyano-2-(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-2-phenyl-1H-pyrazole-4-carbonitrile IUPAC Name: 5-amino-3-[1-cyano-2-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-2-phenyl-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[1-cyano-2-(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1-phenyl-3-pyrazoline-4-carbonitrile Formula: C19H13N5O2 MolecularWeight: 343.33882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=C3C=CC(=O)C(=C3)O)C#N)C(=C(N2)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=C3C=CC(=O)C(=C3)O)C#N)C(=C(N2)N)C#N

InChI

InChI=1S/C19H13N5O2/c20-10-13(8-12-6-7-16(25)17(26)9-12)18-15(11-21)19(22)23-24(18)14-4-2-1-3-5-14/h1-9,23,26H,22H2