ethyl 1-[[6-[(2,5-dimethylphenyl)-methyl-sulfamoyl]-4-oxidanylidene-1H-quinolin-3-yl]carbonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[6-[(2,5-dimethylphenyl)-methyl-sulfamoyl]-4-oxidanylidene-1H-quinolin-3-yl]carbonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[6-[(2,5-dimethylphenyl)-methyl-sulfamoyl]-4-oxo-1H-quinoline-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[6-[(2,5-dimethylphenyl)-methylsulfamoyl]-4-oxo-1H-quinolin-3-yl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-[(2,5-dimethylphenyl)-methylsulfamoyl]-4-oxo-1H-quinoline-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[6-[(2,5-dimethylphenyl)-methyl-sulfamoyl]-4-keto-1H-quinoline-3-carbonyl]isonipecotic acid ethyl ester Formula: C27H31N3O6S MolecularWeight: 525.61654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CNC3=C(C2=O)C=C(C=C3)S(=O)(=O)N(C)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CNC3=C(C2=O)C=C(C=C3)S(=O)(=O)N(C)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C27H31N3O6S/c1-5-36-27(33)19-10-12-30(13-11-19)26(32)22-16-28-23-9-8-20(15-21(23)25(22)31)37(34,35)29(4)24-14-17(2)6-7-18(24)3/h6-9,14-16,19H,5,10-13H2,1-4H3,(H,28,31)