(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(3S)-1-phenylmethoxycarbonylpiperidin-3-yl]propanoic acid

Systemtic Name: (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(3S)-1-phenylmethoxycarbonylpiperidin-3-yl]propanoic acid Openeye Name: (3R)-3-[(3S)-1-benzyloxycarbonyl-3-piperidyl]-3-(tert-butoxycarbonylamino)propanoic acid CAS Name: (3R)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(3S)-1-phenylmethoxycarbonyl-3-piperidinyl]propanoic acid IUPAC Name: (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(3S)-1-phenylmethoxycarbonylpiperidin-3-yl]propanoic acid Traditional Name: (3R)-3-(tert-butoxycarbonylamino)-3-[(3S)-1-carbobenzoxy-3-piperidyl]propionic acid Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)O)C1CCCN(C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC(=O)O)[C@H]1CCCN(C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H30N2O6/c1-21(2,3)29-19(26)22-17(12-18(24)25)16-10-7-11-23(13-16)20(27)28-14-15-8-5-4-6-9-15/h4-6,8-9,16-17H,7,10-14H2,1-3H3,(H,22,26)(H,24,25)/t16-,17+/m0/s1