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

Systemtic Name: phenyl 3-[(1-bromanyl-4-cyclohexyl-piperidin-4-yl)methyl]-4-methyl-2-oxidanylidene-4-phenyl-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[(1-bromo-4-cyclohexyl-4-piperidyl)methyl]-4-methyl-2-oxo-4-phenyl-imidazolidine-1-sulfonate CAS Name: 3-[(1-bromo-4-cyclohexyl-4-piperidinyl)methyl]-4-methyl-2-oxo-4-phenyl-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(1-bromo-4-cyclohexylpiperidin-4-yl)methyl]-4-methyl-2-oxo-4-phenylimidazolidine-1-sulfonate Traditional Name: 3-[(1-bromo-4-cyclohexyl-4-piperidyl)methyl]-2-keto-4-methyl-4-phenyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C28H36BrN3O4S MolecularWeight: 590.57214

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)N1CC2(CCN(CC2)Br)C3CCCCC3)S(=O)(=O)OC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1(CN(C(=O)N1CC2(CCN(CC2)Br)C3CCCCC3)S(=O)(=O)OC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H36BrN3O4S/c1-27(23-11-5-2-6-12-23)21-32(37(34,35)36-25-15-9-4-10-16-25)26(33)31(27)22-28(17-19-30(29)20-18-28)24-13-7-3-8-14-24/h2,4-6,9-12,15-16,24H,3,7-8,13-14,17-22H2,1H3