ethyl 1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[4-(4-methylpiperidino)sulfonylphenyl]sulfonylisonipecotic acid ethyl ester Formula: C20H30N2O6S2 MolecularWeight: 458.592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C

InChI

InChI=1S/C20H30N2O6S2/c1-3-28-20(23)17-10-14-22(15-11-17)30(26,27)19-6-4-18(5-7-19)29(24,25)21-12-8-16(2)9-13-21/h4-7,16-17H,3,8-15H2,1-2H3