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

Systemtic Name: (6E)-6-[4-(3-bromophenyl)carbonyl-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[4-(3-bromobenzoyl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[4-[(3-bromophenyl)-oxomethyl]-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[4-(3-bromobenzoyl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[4-(3-bromobenzoyl)-3-pyrazolin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C16H11BrN2O2 MolecularWeight: 343.17474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=CNN2)C(=O)C3=CC(=CC=C3)Br)C(=O)C=C1

Isomeric SMILES

C1=C/C(=C\2/C(=CNN2)C(=O)C3=CC(=CC=C3)Br)/C(=O)C=C1

InChI

InChI=1S/C16H11BrN2O2/c17-11-5-3-4-10(8-11)16(21)13-9-18-19-15(13)12-6-1-2-7-14(12)20/h1-9,18-19H/b15-12+