6-[5-(3-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-4-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[5-(3-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-4-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[5-(3-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-4-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[5-(3-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-4-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[5-(3-bromophenyl)-1,2-dihydropyrazol-3-ylidene]-4-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[5-(3-bromophenyl)-3-pyrazolin-3-ylidene]-4-methoxy-cyclohexa-2,4-dien-1-one Formula: C16H13BrN2O2 MolecularWeight: 345.19062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C=C(NN2)C3=CC(=CC=C3)Br)C(=O)C=C1

Isomeric SMILES

COC1=CC(=C2C=C(NN2)C3=CC(=CC=C3)Br)C(=O)C=C1

InChI

InChI=1S/C16H13BrN2O2/c1-21-12-5-6-16(20)13(8-12)15-9-14(18-19-15)10-3-2-4-11(17)7-10/h2-9,18-19H,1H3