(2,2,4-trimethyl-1H-quinolin-6-yl) phenylmethanesulfonate

Systemtic Name: (2,2,4-trimethyl-1H-quinolin-6-yl) phenylmethanesulfonate Openeye Name: (2,2,4-trimethyl-1H-quinolin-6-yl) phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester IUPAC Name: (2,2,4-trimethyl-1H-quinolin-6-yl) phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC2=C1C=C(C=C2)OS(=O)(=O)CC3=CC=CC=C3)(C)C

Isomeric SMILES

CC1=CC(NC2=C1C=C(C=C2)OS(=O)(=O)CC3=CC=CC=C3)(C)C

InChI

InChI=1S/C19H21NO3S/c1-14-12-19(2,3)20-18-10-9-16(11-17(14)18)23-24(21,22)13-15-7-5-4-6-8-15/h4-12,20H,13H2,1-3H3