(E)-but-2-enedioic acid; 2,3-dihydro-1H-quinazolin-4-one

Systemtic Name: (E)-but-2-enedioic acid; 2,3-dihydro-1H-quinazolin-4-one Openeye Name: 2,3-dihydro-1H-quinazolin-4-one; fumaric acid CAS Name: (E)-2-butenedioic acid; 2,3-dihydro-1H-quinazolin-4-one IUPAC Name: (E)-but-2-enedioic acid; 2,3-dihydro-1H-quinazolin-4-one Traditional Name: 2,3-dihydro-1H-quinazolin-4-one; fumaric acid Formula: C12H12N2O5 MolecularWeight: 264.23408

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2=CC=CC=C2C(=O)N1.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1NC2=CC=CC=C2C(=O)N1.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C8H8N2O.C4H4O4/c11-8-6-3-1-2-4-7(6)9-5-10-8;5-3(6)1-2-4(7)8/h1-4,9H,5H2,(H,10,11);1-2H,(H,5,6)(H,7,8)/b;2-1+