[2-[2-[2-(3-bromanyl-5-methoxy-phenyl)ethylamino]-2-oxidanylidene-ethyl]phenyl] benzoate

Systemtic Name: [2-[2-[2-(3-bromanyl-5-methoxy-phenyl)ethylamino]-2-oxidanylidene-ethyl]phenyl] benzoate Openeye Name: [2-[2-[2-(3-bromo-5-methoxy-phenyl)ethylamino]-2-oxo-ethyl]phenyl] benzoate CAS Name: benzoic acid [2-[2-[2-(3-bromo-5-methoxyphenyl)ethylamino]-2-oxoethyl]phenyl] ester IUPAC Name: [2-[2-[2-(3-bromo-5-methoxyphenyl)ethylamino]-2-oxoethyl]phenyl] benzoate Traditional Name: benzoic acid [2-[2-[2-(3-bromo-5-methoxy-phenyl)ethylamino]-2-keto-ethyl]phenyl] ester Formula: C24H22BrNO4 MolecularWeight: 468.33978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCNC(=O)CC2=CC=CC=C2OC(=O)C3=CC=CC=C3)Br

Isomeric SMILES

COC1=CC(=CC(=C1)CCNC(=O)CC2=CC=CC=C2OC(=O)C3=CC=CC=C3)Br

InChI

InChI=1S/C24H22BrNO4/c1-29-21-14-17(13-20(25)16-21)11-12-26-23(27)15-19-9-5-6-10-22(19)30-24(28)18-7-3-2-4-8-18/h2-10,13-14,16H,11-12,15H2,1H3,(H,26,27)