phenyl 2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanesulfonate

Systemtic Name: phenyl 2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanesulfonate Openeye Name: phenyl 2-(2-methyl-4-oxo-quinazolin-3-yl)ethanesulfonate CAS Name: 2-(2-methyl-4-oxo-3-quinazolinyl)ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-(2-methyl-4-oxoquinazolin-3-yl)ethanesulfonate Traditional Name: 2-(4-keto-2-methyl-quinazolin-3-yl)ethanesulfonic acid phenyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCS(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCS(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C17H16N2O4S/c1-13-18-16-10-6-5-9-15(16)17(20)19(13)11-12-24(21,22)23-14-7-3-2-4-8-14/h2-10H,11-12H2,1H3