[2-[4-(4-bromophenyl)phenyl]-2-oxidanylidene-ethyl] 6-methoxypyridine-3-carboxylate

Systemtic Name: [2-[4-(4-bromophenyl)phenyl]-2-oxidanylidene-ethyl] 6-methoxypyridine-3-carboxylate Openeye Name: [2-[4-(4-bromophenyl)phenyl]-2-oxo-ethyl] 6-methoxypyridine-3-carboxylate CAS Name: 6-methoxy-3-pyridinecarboxylic acid [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] 6-methoxypyridine-3-carboxylate Traditional Name: 6-methoxynicotinic acid [2-[4-(4-bromophenyl)phenyl]-2-keto-ethyl] ester Formula: C21H16BrNO4 MolecularWeight: 426.26004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=NC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H16BrNO4/c1-26-20-11-8-17(12-23-20)21(25)27-13-19(24)16-4-2-14(3-5-16)15-6-9-18(22)10-7-15/h2-12H,13H2,1H3