N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methyl-3-piperidinosulfonyl-benzamide Formula: C21H32N2O3S MolecularWeight: 392.55538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H32N2O3S/c1-15-8-7-9-19(17(15)3)22-21(24)18-11-10-16(2)20(14-18)27(25,26)23-12-5-4-6-13-23/h10-11,14-15,17,19H,4-9,12-13H2,1-3H3,(H,22,24)/t15-,17+,19-/m0/s1