(phenylmethyl) 2-[[2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanoyl]amino]-4-piperidin-1-yl-butanoate

Systemtic Name: (phenylmethyl) 2-[[2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanoyl]amino]-4-piperidin-1-yl-butanoate Openeye Name: benzyl 2-[[2-(cyclohexylmethyl)-4-morpholino-4-oxo-butanoyl]amino]-4-(1-piperidyl)butanoate CAS Name: 2-[[2-(cyclohexylmethyl)-4-(4-morpholinyl)-1,4-dioxobutyl]amino]-4-(1-piperidinyl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxobutanoyl]amino]-4-piperidin-1-ylbutanoate Traditional Name: 2-[[2-(cyclohexylmethyl)-4-keto-4-morpholino-butanoyl]amino]-4-piperidino-butyric acid benzyl ester Formula: C31H47N3O5 MolecularWeight: 541.72198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC(=O)N2CCOCC2)C(=O)NC(CCN3CCCCC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CC(CC(=O)N2CCOCC2)C(=O)NC(CCN3CCCCC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H47N3O5/c35-29(34-18-20-38-21-19-34)23-27(22-25-10-4-1-5-11-25)30(36)32-28(14-17-33-15-8-3-9-16-33)31(37)39-24-26-12-6-2-7-13-26/h2,6-7,12-13,25,27-28H,1,3-5,8-11,14-24H2,(H,32,36)