ethyl 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]piperidine-4-carboxylate Openeye Name: ethyl 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]piperidine-4-carboxylate CAS Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]piperidine-4-carboxylate Traditional Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]isonipecotic acid ethyl ester Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCNCC1)CS(=O)(=O)C2=CC=C(C=C2)OCC#CC

Isomeric SMILES

CCOC(=O)C1(CCNCC1)CS(=O)(=O)C2=CC=C(C=C2)OCC#CC

InChI

InChI=1S/C19H25NO5S/c1-3-5-14-25-16-6-8-17(9-7-16)26(22,23)15-19(18(21)24-4-2)10-12-20-13-11-19/h6-9,20H,4,10-15H2,1-2H3