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

Systemtic Name: phenyl 3-[[4-cyclohexyl-1-(phenylmethyl)piperidin-4-yl]methyl]-4-ethyl-4-methyl-2-oxidanylidene-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[(1-benzyl-4-cyclohexyl-4-piperidyl)methyl]-4-ethyl-4-methyl-2-oxo-imidazolidine-1-sulfonate CAS Name: 3-[[4-cyclohexyl-1-(phenylmethyl)-4-piperidinyl]methyl]-4-ethyl-4-methyl-2-oxo-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(1-benzyl-4-cyclohexylpiperidin-4-yl)methyl]-4-ethyl-4-methyl-2-oxoimidazolidine-1-sulfonate Traditional Name: 3-[(1-benzyl-4-cyclohexyl-4-piperidyl)methyl]-4-ethyl-2-keto-4-methyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C31H43N3O4S MolecularWeight: 553.75582

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(C(=O)N1CC2(CCN(CC2)CC3=CC=CC=C3)C4CCCCC4)S(=O)(=O)OC5=CC=CC=C5)C

Isomeric SMILES

CCC1(CN(C(=O)N1CC2(CCN(CC2)CC3=CC=CC=C3)C4CCCCC4)S(=O)(=O)OC5=CC=CC=C5)C

InChI

InChI=1S/C31H43N3O4S/c1-3-30(2)24-34(39(36,37)38-28-17-11-6-12-18-28)29(35)33(30)25-31(27-15-9-5-10-16-27)19-21-32(22-20-31)23-26-13-7-4-8-14-26/h4,6-8,11-14,17-18,27H,3,5,9-10,15-16,19-25H2,1-2H3