[(1R)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: [(1R)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: [(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid [(1R)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: [(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl] 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid [(1R)-2-keto-1-phenyl-2-pyrrolidino-ethyl] ester Formula: C24H29NO6 MolecularWeight: 427.49016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)O[C@H](C2=CC=CC=C2)C(=O)N3CCCC3

InChI

InChI=1S/C24H29NO6/c1-28-19-15-17(16-20(29-2)23(19)30-3)11-12-21(26)31-22(18-9-5-4-6-10-18)24(27)25-13-7-8-14-25/h4-6,9-10,15-16,22H,7-8,11-14H2,1-3H3/t22-/m1/s1