[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-(4-methoxyphenyl)methanone Openeye Name: [1-(3,4-dimethylphenyl)sulfonyl-4-piperidyl]-(4-methoxyphenyl)methanone CAS Name: [1-(3,4-dimethylphenyl)sulfonyl-4-piperidinyl]-(4-methoxyphenyl)methanone IUPAC Name: [1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-(4-methoxyphenyl)methanone Traditional Name: [1-(3,4-dimethylphenyl)sulfonyl-4-piperidyl]-(4-methoxyphenyl)methanone Formula: C21H25NO4S MolecularWeight: 387.4925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)C3=CC=C(C=C3)OC)C

InChI

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