3-[(4-nitrophenyl)methoxy]-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: 3-[(4-nitrophenyl)methoxy]-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: 3-[(4-nitrophenyl)methoxy]-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one CAS Name: 3-[(4-nitrophenyl)methoxy]-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: 3-[(4-nitrophenyl)methoxy]-6-(4-phenyl-1,2-dihydropyrazol-3-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: 3-(4-nitrobenzyl)oxy-6-(4-phenyl-3-pyrazolin-3-ylidene)cyclohexa-2,4-dien-1-one Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CNNC2=C3C=CC(=CC3=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CNNC2=C3C=CC(=CC3=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O4/c26-21-12-18(29-14-15-6-8-17(9-7-15)25(27)28)10-11-19(21)22-20(13-23-24-22)16-4-2-1-3-5-16/h1-13,23-24H,14H2