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

Systemtic Name: phenyl 1-chloranyl-3-[[4-cyclohexyl-1-(phenylmethyl)piperidin-4-yl]methyl]-4-methyl-2-oxidanylidene-imidazolidine-4-sulfonate Openeye Name: phenyl 3-[(1-benzyl-4-cyclohexyl-4-piperidyl)methyl]-1-chloro-4-methyl-2-oxo-imidazolidine-4-sulfonate CAS Name: 1-chloro-3-[[4-cyclohexyl-1-(phenylmethyl)-4-piperidinyl]methyl]-4-methyl-2-oxo-4-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(1-benzyl-4-cyclohexylpiperidin-4-yl)methyl]-1-chloro-4-methyl-2-oxoimidazolidine-4-sulfonate Traditional Name: 3-[(1-benzyl-4-cyclohexyl-4-piperidyl)methyl]-1-chloro-2-keto-4-methyl-imidazolidine-4-sulfonic acid phenyl ester Formula: C29H38ClN3O4S MolecularWeight: 560.14772

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)N1CC2(CCN(CC2)CC3=CC=CC=C3)C4CCCCC4)Cl)S(=O)(=O)OC5=CC=CC=C5

Isomeric SMILES

CC1(CN(C(=O)N1CC2(CCN(CC2)CC3=CC=CC=C3)C4CCCCC4)Cl)S(=O)(=O)OC5=CC=CC=C5

InChI

InChI=1S/C29H38ClN3O4S/c1-28(38(35,36)37-26-15-9-4-10-16-26)22-33(30)27(34)32(28)23-29(25-13-7-3-8-14-25)17-19-31(20-18-29)21-24-11-5-2-6-12-24/h2,4-6,9-12,15-16,25H,3,7-8,13-14,17-23H2,1H3