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

Systemtic Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl] (3R)-3-phenylbutanoate Openeye Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxo-ethyl] (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl] (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid [2-keto-2-(veratrylamino)ethyl] ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)NCC1=CC(=C(C=C1)OC)OC)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CC(=O)OCC(=O)NCC1=CC(=C(C=C1)OC)OC)C2=CC=CC=C2

InChI

InChI=1S/C21H25NO5/c1-15(17-7-5-4-6-8-17)11-21(24)27-14-20(23)22-13-16-9-10-18(25-2)19(12-16)26-3/h4-10,12,15H,11,13-14H2,1-3H3,(H,22,23)/t15-/m1/s1