4-[(2-azanyl-3-cyclohexyl-3-oxidanyl-propanoyl)-butyl-amino]-N-(2-morpholin-4-ylethyl)-1-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 4-[(2-azanyl-3-cyclohexyl-3-oxidanyl-propanoyl)-butyl-amino]-N-(2-morpholin-4-ylethyl)-1-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 4-[(2-amino-3-cyclohexyl-3-hydroxy-propanoyl)-butyl-amino]-1-benzyl-N-(2-morpholinoethyl)piperidine-4-carboxamide CAS Name: 4-[(2-amino-3-cyclohexyl-3-hydroxy-1-oxopropyl)-butylamino]-N-[2-(4-morpholinyl)ethyl]-1-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 4-[(2-amino-3-cyclohexyl-3-hydroxypropanoyl)-butylamino]-1-benzyl-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide Traditional Name: 4-[(2-amino-3-cyclohexyl-3-hydroxy-propanoyl)-butyl-amino]-1-benzyl-N-(2-morpholinoethyl)isonipecotamide Formula: C32H53N5O4 MolecularWeight: 571.79432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)C(C(C1CCCCC1)O)N)C2(CCN(CC2)CC3=CC=CC=C3)C(=O)NCCN4CCOCC4

Isomeric SMILES

CCCCN(C(=O)C(C(C1CCCCC1)O)N)C2(CCN(CC2)CC3=CC=CC=C3)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C32H53N5O4/c1-2-3-17-37(30(39)28(33)29(38)27-12-8-5-9-13-27)32(31(40)34-16-20-35-21-23-41-24-22-35)14-18-36(19-15-32)25-26-10-6-4-7-11-26/h4,6-7,10-11,27-29,38H,2-3,5,8-9,12-25,33H2,1H3,(H,34,40)