ethyl 1-[3-(4-ethylphenyl)sulfonyl-6-methyl-quinolin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(4-ethylphenyl)sulfonyl-6-methyl-quinolin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(4-ethylphenyl)sulfonyl-6-methyl-4-quinolyl]piperidine-4-carboxylate CAS Name: 1-[3-(4-ethylphenyl)sulfonyl-6-methyl-4-quinolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(4-ethylphenyl)sulfonyl-6-methylquinolin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[3-(4-ethylphenyl)sulfonyl-6-methyl-4-quinolyl]isonipecotic acid ethyl ester Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)C2=CN=C3C=CC(=CC3=C2N4CCC(CC4)C(=O)OCC)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)C2=CN=C3C=CC(=CC3=C2N4CCC(CC4)C(=O)OCC)C

InChI

InChI=1S/C26H30N2O4S/c1-4-19-7-9-21(10-8-19)33(30,31)24-17-27-23-11-6-18(3)16-22(23)25(24)28-14-12-20(13-15-28)26(29)32-5-2/h6-11,16-17,20H,4-5,12-15H2,1-3H3