[3-[(4-methylphenyl)sulfonylmethyl]phenyl]-[(2S)-2-methylpiperidin-1-yl]methanone

Systemtic Name: [3-[(4-methylphenyl)sulfonylmethyl]phenyl]-[(2S)-2-methylpiperidin-1-yl]methanone Openeye Name: [(2S)-2-methyl-1-piperidyl]-[3-(p-tolylsulfonylmethyl)phenyl]methanone CAS Name: [3-[(4-methylphenyl)sulfonylmethyl]phenyl]-[(2S)-2-methyl-1-piperidinyl]methanone IUPAC Name: [3-[(4-methylphenyl)sulfonylmethyl]phenyl]-[(2S)-2-methylpiperidin-1-yl]methanone Traditional Name: [(2S)-2-methylpiperidino]-[3-(tosylmethyl)phenyl]methanone Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C[C@H]1CCCCN1C(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H25NO3S/c1-16-9-11-20(12-10-16)26(24,25)15-18-7-5-8-19(14-18)21(23)22-13-4-3-6-17(22)2/h5,7-12,14,17H,3-4,6,13,15H2,1-2H3/t17-/m0/s1