phenyl 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)piperidin-4-yl]methyl]-4-methyl-2-oxidanylidene-4-propan-2-ylsulfonyl-imidazolidine-1-sulfonate

Systemtic Name: phenyl 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)piperidin-4-yl]methyl]-4-methyl-2-oxidanylidene-4-propan-2-ylsulfonyl-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)-4-piperidyl]methyl]-4-isopropylsulfonyl-4-methyl-2-oxo-imidazolidine-1-sulfonate CAS Name: 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)-4-piperidinyl]methyl]-4-methyl-2-oxo-4-propan-2-ylsulfonyl-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)piperidin-4-yl]methyl]-4-methyl-2-oxo-4-propan-2-ylsulfonylimidazolidine-1-sulfonate Traditional Name: 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)-4-piperidyl]methyl]-4-isopropylsulfonyl-2-keto-4-methyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C31H43N3O7S2 MolecularWeight: 633.81902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1(CN(C(=O)N1CC2(CCN(CC2)C3=CC=CC=C3O)C4CCCCC4)S(=O)(=O)OC5=CC=CC=C5)C

Isomeric SMILES

CC(C)S(=O)(=O)C1(CN(C(=O)N1CC2(CCN(CC2)C3=CC=CC=C3O)C4CCCCC4)S(=O)(=O)OC5=CC=CC=C5)C

InChI

InChI=1S/C31H43N3O7S2/c1-24(2)42(37,38)30(3)22-34(43(39,40)41-26-14-8-5-9-15-26)29(36)33(30)23-31(25-12-6-4-7-13-25)18-20-32(21-19-31)27-16-10-11-17-28(27)35/h5,8-11,14-17,24-25,35H,4,6-7,12-13,18-23H2,1-3H3