[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 3-quinolin-2-ylpropanoate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 3-quinolin-2-ylpropanoate Openeye Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 3-(2-quinolyl)propanoate CAS Name: 3-(2-quinolinyl)propanoic acid [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 3-quinolin-2-ylpropanoate Traditional Name: 3-(2-quinolyl)propionic acid [2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl] ester Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CCC(=O)OCC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CCC(=O)OCC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H21N3O5S/c22-30(27,28)18-10-5-15(6-11-18)13-23-20(25)14-29-21(26)12-9-17-8-7-16-3-1-2-4-19(16)24-17/h1-8,10-11H,9,12-14H2,(H,23,25)(H2,22,27,28)