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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=C2C(=CNN2)C3=CC=C(C=C3)Br)C=C1

Isomeric SMILES

COC1=CC(=O)C(=C2C(=CNN2)C3=CC=C(C=C3)Br)C=C1

InChI

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