methyl 1-[[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[3-(3,5-dimethylpiperidino)sulfonylbenzoyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C22H32N2O5S MolecularWeight: 436.56488

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3(CCCCC3)C(=O)OC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3(CCCCC3)C(=O)OC)C

InChI

InChI=1S/C22H32N2O5S/c1-16-12-17(2)15-24(14-16)30(27,28)19-9-7-8-18(13-19)20(25)23-22(21(26)29-3)10-5-4-6-11-22/h7-9,13,16-17H,4-6,10-12,14-15H2,1-3H3,(H,23,25)