[4-[2-(4-hydroxyphenyl)ethyl]piperidin-1-yl]-(2-methyl-5-methylsulfonyl-phenyl)methanone

Systemtic Name: [4-[2-(4-hydroxyphenyl)ethyl]piperidin-1-yl]-(2-methyl-5-methylsulfonyl-phenyl)methanone Openeye Name: [4-[2-(4-hydroxyphenyl)ethyl]-1-piperidyl]-(2-methyl-5-methylsulfonyl-phenyl)methanone CAS Name: [4-[2-(4-hydroxyphenyl)ethyl]-1-piperidinyl]-(2-methyl-5-methylsulfonylphenyl)methanone IUPAC Name: [4-[2-(4-hydroxyphenyl)ethyl]piperidin-1-yl]-(2-methyl-5-methylsulfonylphenyl)methanone Traditional Name: [4-[2-(4-hydroxyphenyl)ethyl]piperidino]-(5-mesyl-2-methyl-phenyl)methanone Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCC(CC2)CCC3=CC=C(C=C3)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCC(CC2)CCC3=CC=C(C=C3)O

InChI

InChI=1S/C22H27NO4S/c1-16-3-10-20(28(2,26)27)15-21(16)22(25)23-13-11-18(12-14-23)5-4-17-6-8-19(24)9-7-17/h3,6-10,15,18,24H,4-5,11-14H2,1-2H3