(4Z)-4-[2-(4-methylphenyl)carbonyl-4-phenyl-1H-pyrazol-3-ylidene]-2-nitro-6-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-4-[2-(4-methylphenyl)carbonyl-4-phenyl-1H-pyrazol-3-ylidene]-2-nitro-6-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-2-hydroxy-4-[2-(4-methylbenzoyl)-4-phenyl-1H-pyrazol-3-ylidene]-6-nitro-cyclohexa-2,5-dien-1-one CAS Name: (4Z)-2-hydroxy-4-[2-[(4-methylphenyl)-oxomethyl]-4-phenyl-1H-pyrazol-3-ylidene]-6-nitro-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-2-hydroxy-4-[2-(4-methylbenzoyl)-4-phenyl-1H-pyrazol-3-ylidene]-6-nitrocyclohexa-2,5-dien-1-one Traditional Name: (4Z)-2-hydroxy-6-nitro-4-(4-phenyl-2-p-toluoyl-3-pyrazolin-3-ylidene)cyclohexa-2,5-dien-1-one Formula: C23H17N3O5 MolecularWeight: 415.39818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(=C3C=C(C(=O)C(=C3)O)[N+](=O)[O-])C(=CN2)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2/C(=C\3/C=C(C(=O)C(=C3)O)[N+](=O)[O-])/C(=CN2)C4=CC=CC=C4

InChI

InChI=1S/C23H17N3O5/c1-14-7-9-16(10-8-14)23(29)25-21(18(13-24-25)15-5-3-2-4-6-15)17-11-19(26(30)31)22(28)20(27)12-17/h2-13,24,27H,1H3/b21-17-