(4-methoxy-3,5-dimethyl-phenyl)-[1-(phenylsulfonyl)piperidin-3-yl]methanone

Systemtic Name: (4-methoxy-3,5-dimethyl-phenyl)-[1-(phenylsulfonyl)piperidin-3-yl]methanone Openeye Name: [1-(benzenesulfonyl)-3-piperidyl]-(4-methoxy-3,5-dimethyl-phenyl)methanone CAS Name: [1-(benzenesulfonyl)-3-piperidinyl]-(4-methoxy-3,5-dimethylphenyl)methanone IUPAC Name: [1-(benzenesulfonyl)piperidin-3-yl]-(4-methoxy-3,5-dimethylphenyl)methanone Traditional Name: (1-besyl-3-piperidyl)-(4-methoxy-3,5-dimethyl-phenyl)methanone Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1OC)C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO4S/c1-15-12-18(13-16(2)21(15)26-3)20(23)17-8-7-11-22(14-17)27(24,25)19-9-5-4-6-10-19/h4-6,9-10,12-13,17H,7-8,11,14H2,1-3H3