[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(3,4-dimethoxyphenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(3,4-dimethoxyphenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-[(3,4-dimethoxybenzoyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-3-phenylpropanoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-[(3,4-dimethoxybenzoyl)amino]-3-phenylpropanoate Traditional Name: 3-phenyl-2-(veratroylamino)propionic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C26H24BrNO6 MolecularWeight: 526.37586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C26H24BrNO6/c1-32-23-13-10-19(15-24(23)33-2)25(30)28-21(14-17-6-4-3-5-7-17)26(31)34-16-22(29)18-8-11-20(27)12-9-18/h3-13,15,21H,14,16H2,1-2H3,(H,28,30)