N-[(3S)-1-(3-chloranyl-2-methyl-phenyl)sulfonylpiperidin-3-yl]-1-methyl-cyclohexane-1-carboxamide

Systemtic Name: N-[(3S)-1-(3-chloranyl-2-methyl-phenyl)sulfonylpiperidin-3-yl]-1-methyl-cyclohexane-1-carboxamide Openeye Name: N-[(3S)-1-(3-chloro-2-methyl-phenyl)sulfonyl-3-piperidyl]-1-methyl-cyclohexanecarboxamide CAS Name: N-[(3S)-1-(3-chloro-2-methylphenyl)sulfonyl-3-piperidinyl]-1-methyl-1-cyclohexanecarboxamide IUPAC Name: N-[(3S)-1-(3-chloro-2-methylphenyl)sulfonylpiperidin-3-yl]-1-methylcyclohexane-1-carboxamide Traditional Name: N-[(3S)-1-(3-chloro-2-methyl-phenyl)sulfonyl-3-piperidyl]-1-methyl-cyclohexanecarboxamide Formula: C20H29ClN2O3S MolecularWeight: 412.97386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCCC(C2)NC(=O)C3(CCCCC3)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCC[C@@H](C2)NC(=O)C3(CCCCC3)C

InChI

InChI=1S/C20H29ClN2O3S/c1-15-17(21)9-6-10-18(15)27(25,26)23-13-7-8-16(14-23)22-19(24)20(2)11-4-3-5-12-20/h6,9-10,16H,3-5,7-8,11-14H2,1-2H3,(H,22,24)/t16-/m0/s1