butyl 2-[[(2S)-1-oxidanylidene-3-phenyl-1-(4-piperidin-1-ylcarbonylpiperidin-1-yl)propan-2-yl]carbamoylamino]benzoate

Systemtic Name: butyl 2-[[(2S)-1-oxidanylidene-3-phenyl-1-(4-piperidin-1-ylcarbonylpiperidin-1-yl)propan-2-yl]carbamoylamino]benzoate Openeye Name: butyl 2-[[(1S)-1-benzyl-2-oxo-2-[4-(piperidine-1-carbonyl)-1-piperidyl]ethyl]carbamoylamino]benzoate CAS Name: 2-[[oxo-[[(2S)-1-oxo-1-[4-[oxo(1-piperidinyl)methyl]-1-piperidinyl]-3-phenylpropan-2-yl]amino]methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 2-[[(2S)-1-oxo-3-phenyl-1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-2-yl]carbamoylamino]benzoate Traditional Name: 2-[[(1S)-1-benzyl-2-keto-2-[4-(piperidine-1-carbonyl)piperidino]ethyl]carbamoylamino]benzoic acid butyl ester Formula: C32H42N4O5 MolecularWeight: 562.69968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC=C1NC(=O)NC(CC2=CC=CC=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCC4

Isomeric SMILES

CCCCOC(=O)C1=CC=CC=C1NC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCC4

InChI

InChI=1S/C32H42N4O5/c1-2-3-22-41-31(39)26-14-8-9-15-27(26)33-32(40)34-28(23-24-12-6-4-7-13-24)30(38)36-20-16-25(17-21-36)29(37)35-18-10-5-11-19-35/h4,6-9,12-15,25,28H,2-3,5,10-11,16-23H2,1H3,(H2,33,34,40)/t28-/m0/s1