(2R,3S)-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-piperidin-4-yl]carbonylamino]-3-oxidanyl-butanoate

Systemtic Name: (2R,3S)-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-piperidin-4-yl]carbonylamino]-3-oxidanyl-butanoate Openeye Name: (2R,3S)-2-[(1-tert-butoxycarbonyl-4-phenyl-piperidine-4-carbonyl)amino]-3-hydroxy-butanoate CAS Name: (2R,3S)-3-hydroxy-2-[[[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenyl-4-piperidinyl]-oxomethyl]amino]butanoate IUPAC Name: (2R,3S)-3-hydroxy-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpiperidine-4-carbonyl]amino]butanoate Traditional Name: (2R,3S)-2-[(1-tert-butoxycarbonyl-4-phenyl-isonipecotoyl)amino]-3-hydroxy-butyrate Formula: C21H29N2O6- MolecularWeight: 405.46476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)C2=CC=CC=C2)O

Isomeric SMILES

C[C@@H]([C@H](C(=O)[O-])NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)C2=CC=CC=C2)O

InChI

InChI=1S/C21H30N2O6/c1-14(24)16(17(25)26)22-18(27)21(15-8-6-5-7-9-15)10-12-23(13-11-21)19(28)29-20(2,3)4/h5-9,14,16,24H,10-13H2,1-4H3,(H,22,27)(H,25,26)/p-1/t14-,16+/m0/s1