[5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 3-acetamido-4-methoxy-benzenesulfonate

Systemtic Name: [5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 3-acetamido-4-methoxy-benzenesulfonate Openeye Name: (5,7-dichloro-2-methyl-8-quinolyl) 3-acetamido-4-methoxy-benzenesulfonate CAS Name: 3-acetamido-4-methoxybenzenesulfonic acid (5,7-dichloro-2-methyl-8-quinolinyl) ester IUPAC Name: (5,7-dichloro-2-methylquinolin-8-yl) 3-acetamido-4-methoxybenzenesulfonate Traditional Name: 3-acetamido-4-methoxy-benzenesulfonic acid (5,7-dichloro-2-methyl-8-quinolyl) ester Formula: C19H16Cl2N2O5S MolecularWeight: 455.31174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC(=C2OS(=O)(=O)C3=CC(=C(C=C3)OC)NC(=O)C)Cl)Cl

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC(=C2OS(=O)(=O)C3=CC(=C(C=C3)OC)NC(=O)C)Cl)Cl

InChI

InChI=1S/C19H16Cl2N2O5S/c1-10-4-6-13-14(20)9-15(21)19(18(13)22-10)28-29(25,26)12-5-7-17(27-3)16(8-12)23-11(2)24/h4-9H,1-3H3,(H,23,24)