[2-(diethylamino)-2-oxidanylidene-ethyl] 3,4-dimethyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl] 3,4-dimethyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: [2-(diethylamino)-2-oxo-ethyl] 3,4-dimethyl-5-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3,4-dimethyl-5-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid [2-(diethylamino)-2-oxoethyl] ester IUPAC Name: [2-(diethylamino)-2-oxoethyl] 3,4-dimethyl-5-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3,4-dimethyl-5-(4-methylpiperidino)sulfonyl-benzoic acid [2-(diethylamino)-2-keto-ethyl] ester Formula: C21H32N2O5S MolecularWeight: 424.55418

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N2CCC(CC2)C)C)C

Isomeric SMILES

CCN(CC)C(=O)COC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N2CCC(CC2)C)C)C

InChI

InChI=1S/C21H32N2O5S/c1-6-22(7-2)20(24)14-28-21(25)18-12-16(4)17(5)19(13-18)29(26,27)23-10-8-15(3)9-11-23/h12-13,15H,6-11,14H2,1-5H3