ethyl 1-[6-methoxy-3-(4-methoxyphenyl)sulfonyl-quinolin-4-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[6-methoxy-3-(4-methoxyphenyl)sulfonyl-quinolin-4-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[6-methoxy-3-(4-methoxyphenyl)sulfonyl-4-quinolyl]piperidine-3-carboxylate CAS Name: 1-[6-methoxy-3-(4-methoxyphenyl)sulfonyl-4-quinolinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-methoxy-3-(4-methoxyphenyl)sulfonylquinolin-4-yl]piperidine-3-carboxylate Traditional Name: 1-[6-methoxy-3-(4-methoxyphenyl)sulfonyl-4-quinolyl]nipecotic acid ethyl ester Formula: C25H28N2O6S MolecularWeight: 484.56462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C3C=C(C=CC3=NC=C2S(=O)(=O)C4=CC=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=C3C=C(C=CC3=NC=C2S(=O)(=O)C4=CC=C(C=C4)OC)OC

InChI

InChI=1S/C25H28N2O6S/c1-4-33-25(28)17-6-5-13-27(16-17)24-21-14-19(32-3)9-12-22(21)26-15-23(24)34(29,30)20-10-7-18(31-2)8-11-20/h7-12,14-15,17H,4-6,13,16H2,1-3H3