3,8-dimethyl-2,4-bis(oxidanylidene)-1H-quinazoline-6-sulfonic acid

Systemtic Name: 3,8-dimethyl-2,4-bis(oxidanylidene)-1H-quinazoline-6-sulfonic acid Openeye Name: 3,8-dimethyl-2,4-dioxo-1H-quinazoline-6-sulfonic acid CAS Name: 3,8-dimethyl-2,4-dioxo-1H-quinazoline-6-sulfonic acid IUPAC Name: 3,8-dimethyl-2,4-dioxo-1H-quinazoline-6-sulfonic acid Traditional Name: 2,4-diketo-3,8-dimethyl-1H-quinazoline-6-sulfonic acid Formula: C10H10N2O5S MolecularWeight: 270.2618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)(=O)O)C(=O)N(C(=O)N2)C

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)(=O)O)C(=O)N(C(=O)N2)C

InChI

InChI=1S/C10H10N2O5S/c1-5-3-6(18(15,16)17)4-7-8(5)11-10(14)12(2)9(7)13/h3-4H,1-2H3,(H,11,14)(H,15,16,17)