(2-methylquinolin-8-yl) 4-(acetamidomethyl)benzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 4-(acetamidomethyl)benzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 4-(acetamidomethyl)benzenesulfonate CAS Name: 4-(acetamidomethyl)benzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 4-(acetamidomethyl)benzenesulfonate Traditional Name: 4-(acetamidomethyl)benzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=CC=C(C=C3)CNC(=O)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=CC=C(C=C3)CNC(=O)C)C=C1

InChI

InChI=1S/C19H18N2O4S/c1-13-6-9-16-4-3-5-18(19(16)21-13)25-26(23,24)17-10-7-15(8-11-17)12-20-14(2)22/h3-11H,12H2,1-2H3,(H,20,22)