(E)-3-(6-nitro-4-oxidanylidene-quinazolin-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(6-nitro-4-oxidanylidene-quinazolin-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(6-nitro-4-oxo-quinazolin-3-yl)prop-2-enoic acid CAS Name: (E)-3-(6-nitro-4-oxo-3-quinazolinyl)-2-propenoic acid IUPAC Name: (E)-3-(6-nitro-4-oxoquinazolin-3-yl)prop-2-enoic acid Traditional Name: (E)-3-(4-keto-6-nitro-quinazolin-3-yl)acrylic acid Formula: C11H7N3O5 MolecularWeight: 261.19038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C=N2)C=CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C=N2)/C=C/C(=O)O

InChI

InChI=1S/C11H7N3O5/c15-10(16)3-4-13-6-12-9-2-1-7(14(18)19)5-8(9)11(13)17/h1-6H,(H,15,16)/b4-3+