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

Systemtic Name: phenyl 3-[(4-cyclohexyl-1-iodanyl-piperidin-4-yl)methyl]-4-(2-hydroxyphenyl)-4-methyl-2-oxidanylidene-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[(4-cyclohexyl-1-iodo-4-piperidyl)methyl]-4-(2-hydroxyphenyl)-4-methyl-2-oxo-imidazolidine-1-sulfonate CAS Name: 3-[(4-cyclohexyl-1-iodo-4-piperidinyl)methyl]-4-(2-hydroxyphenyl)-4-methyl-2-oxo-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(4-cyclohexyl-1-iodopiperidin-4-yl)methyl]-4-(2-hydroxyphenyl)-4-methyl-2-oxoimidazolidine-1-sulfonate Traditional Name: 3-[(4-cyclohexyl-1-iodo-4-piperidyl)methyl]-4-(2-hydroxyphenyl)-2-keto-4-methyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C28H36IN3O5S MolecularWeight: 653.57201

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)N1CC2(CCN(CC2)I)C3CCCCC3)S(=O)(=O)OC4=CC=CC=C4)C5=CC=CC=C5O

Isomeric SMILES

CC1(CN(C(=O)N1CC2(CCN(CC2)I)C3CCCCC3)S(=O)(=O)OC4=CC=CC=C4)C5=CC=CC=C5O

InChI

InChI=1S/C28H36IN3O5S/c1-27(24-14-8-9-15-25(24)33)20-32(38(35,36)37-23-12-6-3-7-13-23)26(34)31(27)21-28(16-18-30(29)19-17-28)22-10-4-2-5-11-22/h3,6-9,12-15,22,33H,2,4-5,10-11,16-21H2,1H3