phenyl 4-cyclohexyl-4-[[5,5-dimethyl-2-oxidanylidene-3-(phenylmethyl)imidazolidin-1-yl]methyl]piperidine-1-sulfonate

Systemtic Name: phenyl 4-cyclohexyl-4-[[5,5-dimethyl-2-oxidanylidene-3-(phenylmethyl)imidazolidin-1-yl]methyl]piperidine-1-sulfonate Openeye Name: phenyl 4-[(3-benzyl-5,5-dimethyl-2-oxo-imidazolidin-1-yl)methyl]-4-cyclohexyl-piperidine-1-sulfonate CAS Name: 4-cyclohexyl-4-[[5,5-dimethyl-2-oxo-3-(phenylmethyl)-1-imidazolidinyl]methyl]-1-piperidinesulfonic acid phenyl ester IUPAC Name: phenyl 4-[(3-benzyl-5,5-dimethyl-2-oxoimidazolidin-1-yl)methyl]-4-cyclohexylpiperidine-1-sulfonate Traditional Name: 4-[(3-benzyl-2-keto-5,5-dimethyl-imidazolidin-1-yl)methyl]-4-cyclohexyl-piperidine-1-sulfonic acid phenyl ester Formula: C30H41N3O4S MolecularWeight: 539.72924

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C30H41N3O4S/c1-29(2)23-31(22-25-12-6-3-7-13-25)28(34)33(29)24-30(26-14-8-4-9-15-26)18-20-32(21-19-30)38(35,36)37-27-16-10-5-11-17-27/h3,5-7,10-13,16-17,26H,4,8-9,14-15,18-24H2,1-2H3