tert-butyl (3S)-3-[[(1S)-2-oxidanyl-1-phenyl-ethyl]amino]-3-pyridin-3-yl-propanoate

Systemtic Name: tert-butyl (3S)-3-[[(1S)-2-oxidanyl-1-phenyl-ethyl]amino]-3-pyridin-3-yl-propanoate Openeye Name: tert-butyl (3S)-3-[[(1S)-2-hydroxy-1-phenyl-ethyl]amino]-3-(3-pyridyl)propanoate CAS Name: (3S)-3-[[(1S)-2-hydroxy-1-phenylethyl]amino]-3-(3-pyridinyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-[[(1S)-2-hydroxy-1-phenylethyl]amino]-3-pyridin-3-ylpropanoate Traditional Name: (3S)-3-[[(1S)-2-hydroxy-1-phenyl-ethyl]amino]-3-(3-pyridyl)propionic acid tert-butyl ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C1=CN=CC=C1)NC(CO)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H](C1=CN=CC=C1)N[C@H](CO)C2=CC=CC=C2

InChI

InChI=1S/C20H26N2O3/c1-20(2,3)25-19(24)12-17(16-10-7-11-21-13-16)22-18(14-23)15-8-5-4-6-9-15/h4-11,13,17-18,22-23H,12,14H2,1-3H3/t17-,18+/m0/s1