ethyl (2S,3R)-2-acetyloxy-4-[methyl-(phenylmethyl)amino]-3-phenyl-butanoate

Systemtic Name: ethyl (2S,3R)-2-acetyloxy-4-[methyl-(phenylmethyl)amino]-3-phenyl-butanoate Openeye Name: ethyl (2S,3R)-2-acetoxy-4-[benzyl(methyl)amino]-3-phenyl-butanoate CAS Name: (2S,3R)-2-acetyloxy-4-[methyl-(phenylmethyl)amino]-3-phenylbutanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2-acetyloxy-4-[benzyl(methyl)amino]-3-phenylbutanoate Traditional Name: (2S,3R)-2-acetoxy-4-[benzyl(methyl)amino]-3-phenyl-butyric acid ethyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CN(C)CC1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C

Isomeric SMILES

CCOC(=O)[C@H]([C@@H](CN(C)CC1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C22H27NO4/c1-4-26-22(25)21(27-17(2)24)20(19-13-9-6-10-14-19)16-23(3)15-18-11-7-5-8-12-18/h5-14,20-21H,4,15-16H2,1-3H3/t20-,21-/m0/s1