1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[(2-oxidanylidene-4-phenylmethoxycarbonyl-piperazin-1-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[(2-oxidanylidene-4-phenylmethoxycarbonyl-piperazin-1-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 4-[(4-benzyloxycarbonyl-2-oxo-piperazin-1-yl)methyl]-1-tert-butoxycarbonyl-piperidine-4-carboxylic acid CAS Name: 1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-[(2-oxo-4-phenylmethoxycarbonyl-1-piperazinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[(2-oxo-4-phenylmethoxycarbonylpiperazin-1-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-4-[(4-carbobenzoxy-2-keto-piperazino)methyl]isonipecotic acid Formula: C24H33N3O7 MolecularWeight: 475.53472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(CN2CCN(CC2=O)C(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(CN2CCN(CC2=O)C(=O)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C24H33N3O7/c1-23(2,3)34-22(32)25-11-9-24(10-12-25,20(29)30)17-27-14-13-26(15-19(27)28)21(31)33-16-18-7-5-4-6-8-18/h4-8H,9-17H2,1-3H3,(H,29,30)