ethyl (3S)-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]-3-pyridin-3-yl-propanoate

Systemtic Name: ethyl (3S)-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]-3-pyridin-3-yl-propanoate Openeye Name: ethyl (3S)-3-[benzyl-[(1R)-1-phenylethyl]amino]-3-(3-pyridyl)propanoate CAS Name: (3S)-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]-3-(3-pyridinyl)propanoic acid ethyl ester IUPAC Name: ethyl (3S)-3-[benzyl-[(1R)-1-phenylethyl]amino]-3-pyridin-3-ylpropanoate Traditional Name: (3S)-3-[benzyl-[(1R)-1-phenylethyl]amino]-3-(3-pyridyl)propionic acid ethyl ester Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CN=CC=C1)N(CC2=CC=CC=C2)C(C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C[C@@H](C1=CN=CC=C1)N(CC2=CC=CC=C2)[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O2/c1-3-29-25(28)17-24(23-15-10-16-26-18-23)27(19-21-11-6-4-7-12-21)20(2)22-13-8-5-9-14-22/h4-16,18,20,24H,3,17,19H2,1-2H3/t20-,24+/m1/s1