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

Systemtic Name: ethyl 4-(4-butoxyphenyl)sulfonyl-1-ethyl-piperidine-4-carboxylate Openeye Name: ethyl 4-(4-butoxyphenyl)sulfonyl-1-ethyl-piperidine-4-carboxylate CAS Name: 4-(4-butoxyphenyl)sulfonyl-1-ethyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-butoxyphenyl)sulfonyl-1-ethylpiperidine-4-carboxylate Traditional Name: 4-(4-butoxyphenyl)sulfonyl-1-ethyl-isonipecotic acid ethyl ester Formula: C20H31NO5S MolecularWeight: 397.52884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31NO5S/c1-4-7-16-26-17-8-10-18(11-9-17)27(23,24)20(19(22)25-6-3)12-14-21(5-2)15-13-20/h8-11H,4-7,12-16H2,1-3H3