ethyl 4-(4-butoxyphenyl)sulfonyl-1-methyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-(4-butoxyphenyl)sulfonyl-1-methyl-piperidine-4-carboxylate Openeye Name: ethyl 4-(4-butoxyphenyl)sulfonyl-1-methyl-piperidine-4-carboxylate CAS Name: 4-(4-butoxyphenyl)sulfonyl-1-methyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-butoxyphenyl)sulfonyl-1-methylpiperidine-4-carboxylate Traditional Name: 4-(4-butoxyphenyl)sulfonyl-1-methyl-isonipecotic acid ethyl ester Formula: C19H29NO5S MolecularWeight: 383.50226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)C)C(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)C)C(=O)OCC

InChI

InChI=1S/C19H29NO5S/c1-4-6-15-25-16-7-9-17(10-8-16)26(22,23)19(18(21)24-5-2)11-13-20(3)14-12-19/h7-10H,4-6,11-15H2,1-3H3