4-[2-(4-bromophenyl)-3-(4-hydroxyphenyl)-4-(phenylmethyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(4-bromophenyl)-3-(4-hydroxyphenyl)-4-(phenylmethyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-benzyl-2-(4-bromophenyl)-3-(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(4-bromophenyl)-3-(4-hydroxyphenyl)-4-(phenylmethyl)-1H-pyrazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-benzyl-2-(4-bromophenyl)-3-(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-benzyl-1-(4-bromophenyl)-5-(4-hydroxyphenyl)-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C28H21BrN2O2 MolecularWeight: 497.38254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N(NC2=C3C=CC(=O)C=C3)C4=CC=C(C=C4)Br)C5=CC=C(C=C5)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N(NC2=C3C=CC(=O)C=C3)C4=CC=C(C=C4)Br)C5=CC=C(C=C5)O

InChI

InChI=1S/C28H21BrN2O2/c29-22-10-12-23(13-11-22)31-28(21-8-16-25(33)17-9-21)26(18-19-4-2-1-3-5-19)27(30-31)20-6-14-24(32)15-7-20/h1-17,30,33H,18H2