methyl 1-[[1-(4-methylphenyl)carbonylpiperidin-3-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1-(4-methylphenyl)carbonylpiperidin-3-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-(4-methylbenzoyl)piperidine-3-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-[(4-methylphenyl)-oxomethyl]-3-piperidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-(4-methylbenzoyl)piperidine-3-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[(1-p-toluoylnipecotoyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C22H30N2O4 MolecularWeight: 386.4846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3(CCCCC3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3(CCCCC3)C(=O)OC

InChI

InChI=1S/C22H30N2O4/c1-16-8-10-17(11-9-16)20(26)24-14-6-7-18(15-24)19(25)23-22(21(27)28-2)12-4-3-5-13-22/h8-11,18H,3-7,12-15H2,1-2H3,(H,23,25)