[2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid [2-keto-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C=CC(=O)OCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)/C=C/C(=O)OCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)N=CC=C2

InChI

InChI=1S/C22H21N3O5S/c23-31(28,29)19-9-6-16(7-10-19)12-14-24-20(26)15-30-21(27)11-8-18-4-1-3-17-5-2-13-25-22(17)18/h1-11,13H,12,14-15H2,(H,24,26)(H2,23,28,29)/b11-8+