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

Systemtic Name: phenyl 3-[(4-cyclohexyl-1-ethoxy-piperidin-4-yl)methyl]-4-methyl-4-(2-methylpropyl)-2-oxidanylidene-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[(4-cyclohexyl-1-ethoxy-4-piperidyl)methyl]-4-isobutyl-4-methyl-2-oxo-imidazolidine-1-sulfonate CAS Name: 3-[(4-cyclohexyl-1-ethoxy-4-piperidinyl)methyl]-4-methyl-4-(2-methylpropyl)-2-oxo-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(4-cyclohexyl-1-ethoxypiperidin-4-yl)methyl]-4-methyl-4-(2-methylpropyl)-2-oxoimidazolidine-1-sulfonate Traditional Name: 3-[(4-cyclohexyl-1-ethoxy-4-piperidyl)methyl]-4-isobutyl-2-keto-4-methyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C28H45N3O5S MolecularWeight: 535.739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCON1CCC(CC1)(CN2C(=O)N(CC2(C)CC(C)C)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CCON1CCC(CC1)(CN2C(=O)N(CC2(C)CC(C)C)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C28H45N3O5S/c1-5-35-29-18-16-28(17-19-29,24-12-8-6-9-13-24)22-30-26(32)31(21-27(30,4)20-23(2)3)37(33,34)36-25-14-10-7-11-15-25/h7,10-11,14-15,23-24H,5-6,8-9,12-13,16-22H2,1-4H3