[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl] 3-phenylbutanoate

Systemtic Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl] 3-phenylbutanoate Openeye Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl] 3-phenylbutanoate CAS Name: 3-phenylbutanoic acid [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl] 3-phenylbutanoate Traditional Name: 3-phenylbutyric acid [2-(homoveratrylamino)-2-keto-ethyl] ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)NCCC1=CC(=C(C=C1)OC)OC)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)OCC(=O)NCCC1=CC(=C(C=C1)OC)OC)C2=CC=CC=C2

InChI

InChI=1S/C22H27NO5/c1-16(18-7-5-4-6-8-18)13-22(25)28-15-21(24)23-12-11-17-9-10-19(26-2)20(14-17)27-3/h4-10,14,16H,11-13,15H2,1-3H3,(H,23,24)