3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenylmethoxycarbonyl-piperidine-3-carboxylic acid

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenylmethoxycarbonyl-piperidine-3-carboxylic acid Openeye Name: 1-benzyloxycarbonyl-3-(tert-butoxycarbonylamino)piperidine-3-carboxylic acid CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-phenylmethoxycarbonyl-3-piperidinecarboxylic acid IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid Traditional Name: 3-(tert-butoxycarbonylamino)-1-carbobenzoxy-nipecotic acid Formula: C19H26N2O6 MolecularWeight: 378.41954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(CCCN(C1)C(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1(CCCN(C1)C(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H26N2O6/c1-18(2,3)27-16(24)20-19(15(22)23)10-7-11-21(13-19)17(25)26-12-14-8-5-4-6-9-14/h4-6,8-9H,7,10-13H2,1-3H3,(H,20,24)(H,22,23)