4-[[[2-cyclohexyl-2-(phenylmethoxycarbonylamino)ethanoyl]amino]methyl]piperidine-1-carboxylic acid

Systemtic Name: 4-[[[2-cyclohexyl-2-(phenylmethoxycarbonylamino)ethanoyl]amino]methyl]piperidine-1-carboxylic acid Openeye Name: 4-[[[2-(benzyloxycarbonylamino)-2-cyclohexyl-acetyl]amino]methyl]piperidine-1-carboxylic acid CAS Name: 4-[[[2-cyclohexyl-1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]methyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[[[2-cyclohexyl-2-(phenylmethoxycarbonylamino)acetyl]amino]methyl]piperidine-1-carboxylic acid Traditional Name: 4-[[[2-(benzyloxycarbonylamino)-2-cyclohexyl-acetyl]amino]methyl]piperidine-1-carboxylic acid Formula: C23H33N3O5 MolecularWeight: 431.52522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)NCC2CCN(CC2)C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)C(C(=O)NCC2CCN(CC2)C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H33N3O5/c27-21(24-15-17-11-13-26(14-12-17)23(29)30)20(19-9-5-2-6-10-19)25-22(28)31-16-18-7-3-1-4-8-18/h1,3-4,7-8,17,19-20H,2,5-6,9-16H2,(H,24,27)(H,25,28)(H,29,30)