N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C21H32N2O4S MolecularWeight: 408.55478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@H]1CCC[C@H]([C@@H]1C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H32N2O4S/c1-15-5-4-6-20(16(15)2)22-21(24)17-11-13-23(14-12-17)28(25,26)19-9-7-18(27-3)8-10-19/h7-10,15-17,20H,4-6,11-14H2,1-3H3,(H,22,24)/t15-,16+,20+/m0/s1