[8-(diethylamino)quinolin-6-yl] 2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: [8-(diethylamino)quinolin-6-yl] 2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: [8-(diethylamino)-6-quinolyl] 2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]propanoic acid [8-(diethylamino)-6-quinolinyl] ester IUPAC Name: [8-(diethylamino)quinolin-6-yl] 2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 2-(tosylamino)propionic acid [8-(diethylamino)-6-quinolyl] ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C2C(=CC(=C1)OC(=O)C(C)NS(=O)(=O)C3=CC=C(C=C3)C)C=CC=N2

Isomeric SMILES

CCN(CC)C1=C2C(=CC(=C1)OC(=O)C(C)NS(=O)(=O)C3=CC=C(C=C3)C)C=CC=N2

InChI

InChI=1S/C23H27N3O4S/c1-5-26(6-2)21-15-19(14-18-8-7-13-24-22(18)21)30-23(27)17(4)25-31(28,29)20-11-9-16(3)10-12-20/h7-15,17,25H,5-6H2,1-4H3