ethyl (3S)-3-[[(1R)-2-oxidanyl-1-phenyl-ethyl]-(phenylmethyl)amino]-3-phenyl-propanoate

Systemtic Name: ethyl (3S)-3-[[(1R)-2-oxidanyl-1-phenyl-ethyl]-(phenylmethyl)amino]-3-phenyl-propanoate Openeye Name: ethyl (3S)-3-[benzyl-[(1R)-2-hydroxy-1-phenyl-ethyl]amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[(1R)-2-hydroxy-1-phenylethyl]-(phenylmethyl)amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (3S)-3-[benzyl-[(1R)-2-hydroxy-1-phenylethyl]amino]-3-phenylpropanoate Traditional Name: (3S)-3-[benzyl-[(1R)-2-hydroxy-1-phenyl-ethyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C26H29NO3 MolecularWeight: 403.51336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29NO3/c1-2-30-26(29)18-24(22-14-8-4-9-15-22)27(19-21-12-6-3-7-13-21)25(20-28)23-16-10-5-11-17-23/h3-17,24-25,28H,2,18-20H2,1H3/t24-,25-/m0/s1