2,4-bis(oxidanylidene)-3-propan-2-yl-1H-quinazoline-6-sulfonic acid

Systemtic Name: 2,4-bis(oxidanylidene)-3-propan-2-yl-1H-quinazoline-6-sulfonic acid Openeye Name: 3-isopropyl-2,4-dioxo-1H-quinazoline-6-sulfonic acid CAS Name: 2,4-dioxo-3-propan-2-yl-1H-quinazoline-6-sulfonic acid IUPAC Name: 2,4-dioxo-3-propan-2-yl-1H-quinazoline-6-sulfonic acid Traditional Name: 3-isopropyl-2,4-diketo-1H-quinazoline-6-sulfonic acid Formula: C11H12N2O5S MolecularWeight: 284.28838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C=CC(=C2)S(=O)(=O)O)NC1=O

Isomeric SMILES

CC(C)N1C(=O)C2=C(C=CC(=C2)S(=O)(=O)O)NC1=O

InChI

InChI=1S/C11H12N2O5S/c1-6(2)13-10(14)8-5-7(19(16,17)18)3-4-9(8)12-11(13)15/h3-6H,1-2H3,(H,12,15)(H,16,17,18)