(3-chlorophenyl)-[(3S)-1-(2-methoxy-5-methyl-phenyl)sulfonylpiperidin-3-yl]methanone

Systemtic Name: (3-chlorophenyl)-[(3S)-1-(2-methoxy-5-methyl-phenyl)sulfonylpiperidin-3-yl]methanone Openeye Name: (3-chlorophenyl)-[(3S)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-3-piperidyl]methanone CAS Name: (3-chlorophenyl)-[(3S)-1-(2-methoxy-5-methylphenyl)sulfonyl-3-piperidinyl]methanone IUPAC Name: (3-chlorophenyl)-[(3S)-1-(2-methoxy-5-methylphenyl)sulfonylpiperidin-3-yl]methanone Traditional Name: (3-chlorophenyl)-[(3S)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-3-piperidyl]methanone Formula: C20H22ClNO4S MolecularWeight: 407.91098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCC(C2)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC[C@@H](C2)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClNO4S/c1-14-8-9-18(26-2)19(11-14)27(24,25)22-10-4-6-16(13-22)20(23)15-5-3-7-17(21)12-15/h3,5,7-9,11-12,16H,4,6,10,13H2,1-2H3/t16-/m0/s1