(2,2,4-trimethyl-1H-quinolin-7-yl) 4-acetamidobenzenesulfonate

Systemtic Name: (2,2,4-trimethyl-1H-quinolin-7-yl) 4-acetamidobenzenesulfonate Openeye Name: (2,2,4-trimethyl-1H-quinolin-7-yl) 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid (2,2,4-trimethyl-1H-quinolin-7-yl) ester IUPAC Name: (2,2,4-trimethyl-1H-quinolin-7-yl) 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid (2,2,4-trimethyl-1H-quinolin-7-yl) ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=C(C=C3)NC(=O)C)(C)C

Isomeric SMILES

CC1=CC(NC2=C1C=CC(=C2)OS(=O)(=O)C3=CC=C(C=C3)NC(=O)C)(C)C

InChI

InChI=1S/C20H22N2O4S/c1-13-12-20(3,4)22-19-11-16(7-10-18(13)19)26-27(24,25)17-8-5-15(6-9-17)21-14(2)23/h5-12,22H,1-4H3,(H,21,23)