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

Systemtic Name: phenyl 3-[(1-chloranyl-4-cyclohexyl-piperidin-4-yl)methyl]-4-methyl-2-oxidanylidene-4-propyl-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[(1-chloro-4-cyclohexyl-4-piperidyl)methyl]-4-methyl-2-oxo-4-propyl-imidazolidine-1-sulfonate CAS Name: 3-[(1-chloro-4-cyclohexyl-4-piperidinyl)methyl]-4-methyl-2-oxo-4-propyl-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(1-chloro-4-cyclohexylpiperidin-4-yl)methyl]-4-methyl-2-oxo-4-propylimidazolidine-1-sulfonate Traditional Name: 3-[(1-chloro-4-cyclohexyl-4-piperidyl)methyl]-2-keto-4-methyl-4-propyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C25H38ClN3O4S MolecularWeight: 512.10492

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CN(C(=O)N1CC2(CCN(CC2)Cl)C3CCCCC3)S(=O)(=O)OC4=CC=CC=C4)C

Isomeric SMILES

CCCC1(CN(C(=O)N1CC2(CCN(CC2)Cl)C3CCCCC3)S(=O)(=O)OC4=CC=CC=C4)C

InChI

InChI=1S/C25H38ClN3O4S/c1-3-14-24(2)19-29(34(31,32)33-22-12-8-5-9-13-22)23(30)28(24)20-25(15-17-27(26)18-16-25)21-10-6-4-7-11-21/h5,8-9,12-13,21H,3-4,6-7,10-11,14-20H2,1-2H3