diphenyl 3-[(4-cyclohexyl-1-phenoxysulfonyl-piperidin-4-yl)methyl]-4-methyl-2-oxidanylidene-imidazolidine-1,4-disulfonate

Systemtic Name: diphenyl 3-[(4-cyclohexyl-1-phenoxysulfonyl-piperidin-4-yl)methyl]-4-methyl-2-oxidanylidene-imidazolidine-1,4-disulfonate Openeye Name: diphenyl 3-[(4-cyclohexyl-1-phenoxysulfonyl-4-piperidyl)methyl]-4-methyl-2-oxo-imidazolidine-1,4-disulfonate CAS Name: 3-[(4-cyclohexyl-1-phenoxysulfonyl-4-piperidinyl)methyl]-4-methyl-2-oxoimidazolidine-1,4-disulfonic acid diphenyl ester IUPAC Name: diphenyl 3-[(4-cyclohexyl-1-phenoxysulfonylpiperidin-4-yl)methyl]-4-methyl-2-oxoimidazolidine-1,4-disulfonate Traditional Name: 3-[(4-cyclohexyl-1-phenoxysulfonyl-4-piperidyl)methyl]-2-keto-4-methyl-imidazolidine-1,4-disulfonic acid diphenyl ester Formula: C34H41N3O10S3 MolecularWeight: 747.89844

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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)S(=O)(=O)OC5=CC=CC=C5)S(=O)(=O)OC6=CC=CC=C6

Isomeric SMILES

CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)S(=O)(=O)OC5=CC=CC=C5)S(=O)(=O)OC6=CC=CC=C6

InChI

InChI=1S/C34H41N3O10S3/c1-33(48(39,40)45-29-16-8-3-9-17-29)26-37(50(43,44)47-31-20-12-5-13-21-31)32(38)36(33)27-34(28-14-6-2-7-15-28)22-24-35(25-23-34)49(41,42)46-30-18-10-4-11-19-30/h3-5,8-13,16-21,28H,2,6-7,14-15,22-27H2,1H3