(4-oxidanylidene-1H-quinazolin-6-yl) 4-methylbenzenesulfonate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-6-yl) 4-methylbenzenesulfonate Openeye Name: (4-oxo-1H-quinazolin-6-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-oxo-1H-quinazolin-6-yl) ester IUPAC Name: (4-oxo-1H-quinazolin-6-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-keto-1H-quinazolin-6-yl) ester Formula: C15H12N2O4S MolecularWeight: 316.33178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)NC=NC3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)NC=NC3=O

InChI

InChI=1S/C15H12N2O4S/c1-10-2-5-12(6-3-10)22(19,20)21-11-4-7-14-13(8-11)15(18)17-9-16-14/h2-9H,1H3,(H,16,17,18)