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

Systemtic Name: phenyl 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)piperidin-4-yl]methyl]-4-methyl-1-oxidanyl-2-oxidanylidene-imidazolidine-4-sulfonate Openeye Name: phenyl 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)-4-piperidyl]methyl]-1-hydroxy-4-methyl-2-oxo-imidazolidine-4-sulfonate CAS Name: 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)-4-piperidinyl]methyl]-1-hydroxy-4-methyl-2-oxo-4-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)piperidin-4-yl]methyl]-1-hydroxy-4-methyl-2-oxoimidazolidine-4-sulfonate Traditional Name: 3-[[4-cyclohexyl-1-(2-hydroxyphenyl)-4-piperidyl]methyl]-1-hydroxy-2-keto-4-methyl-imidazolidine-4-sulfonic acid phenyl ester Formula: C28H37N3O6S MolecularWeight: 543.67488

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)N1CC2(CCN(CC2)C3=CC=CC=C3O)C4CCCCC4)O)S(=O)(=O)OC5=CC=CC=C5

Isomeric SMILES

CC1(CN(C(=O)N1CC2(CCN(CC2)C3=CC=CC=C3O)C4CCCCC4)O)S(=O)(=O)OC5=CC=CC=C5

InChI

InChI=1S/C28H37N3O6S/c1-27(38(35,36)37-23-12-6-3-7-13-23)20-31(34)26(33)30(27)21-28(22-10-4-2-5-11-22)16-18-29(19-17-28)24-14-8-9-15-25(24)32/h3,6-9,12-15,22,32,34H,2,4-5,10-11,16-21H2,1H3