1-butyl-2,4-bis(oxidanylidene)quinazoline-5-sulfonic acid

Systemtic Name: 1-butyl-2,4-bis(oxidanylidene)quinazoline-5-sulfonic acid Openeye Name: 1-butyl-2,4-dioxo-quinazoline-5-sulfonic acid CAS Name: 1-butyl-2,4-dioxo-5-quinazolinesulfonic acid IUPAC Name: 1-butyl-2,4-dioxoquinazoline-5-sulfonic acid Traditional Name: 1-butyl-2,4-diketo-quinazoline-5-sulfonic acid Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=CC=C2)S(=O)(=O)O)C(=O)NC1=O

Isomeric SMILES

CCCCN1C2=C(C(=CC=C2)S(=O)(=O)O)C(=O)NC1=O

InChI

InChI=1S/C12H14N2O5S/c1-2-3-7-14-8-5-4-6-9(20(17,18)19)10(8)11(15)13-12(14)16/h4-6H,2-3,7H2,1H3,(H,13,15,16)(H,17,18,19)