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

Systemtic Name: phenyl 3-[(4-cyclohexyl-1-ethoxy-piperidin-4-yl)methyl]-4-methyl-2-oxidanylidene-4-propyl-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[(4-cyclohexyl-1-ethoxy-4-piperidyl)methyl]-4-methyl-2-oxo-4-propyl-imidazolidine-1-sulfonate CAS Name: 3-[(4-cyclohexyl-1-ethoxy-4-piperidinyl)methyl]-4-methyl-2-oxo-4-propyl-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(4-cyclohexyl-1-ethoxypiperidin-4-yl)methyl]-4-methyl-2-oxo-4-propylimidazolidine-1-sulfonate Traditional Name: 3-[(4-cyclohexyl-1-ethoxy-4-piperidyl)methyl]-2-keto-4-methyl-4-propyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C27H43N3O5S MolecularWeight: 521.71242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H43N3O5S/c1-4-16-26(3)21-30(36(32,33)35-24-14-10-7-11-15-24)25(31)29(26)22-27(23-12-8-6-9-13-23)17-19-28(20-18-27)34-5-2/h7,10-11,14-15,23H,4-6,8-9,12-13,16-22H2,1-3H3