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

Systemtic Name: 6-[4-(4-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(4-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(4-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(4-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(4-bromophenyl)-3-pyrazolin-3-ylidene]-3-(4-nitrobenzyl)oxy-cyclohexa-2,4-dien-1-one Formula: C22H16BrN3O4 MolecularWeight: 466.28414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC2=CC(=O)C(=C3C(=CNN3)C4=CC=C(C=C4)Br)C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC2=CC(=O)C(=C3C(=CNN3)C4=CC=C(C=C4)Br)C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H16BrN3O4/c23-16-5-3-15(4-6-16)20-12-24-25-22(20)19-10-9-18(11-21(19)27)30-13-14-1-7-17(8-2-14)26(28)29/h1-12,24-25H,13H2