2-[2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]benzoate

Systemtic Name: 2-[2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]benzoate Openeye Name: 2-[[2-(6-nitro-4-oxo-quinazolin-3-yl)acetyl]amino]benzoate CAS Name: 2-[[2-(6-nitro-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]benzoate IUPAC Name: 2-[[2-(6-nitro-4-oxoquinazolin-3-yl)acetyl]amino]benzoate Traditional Name: 2-[[2-(4-keto-6-nitro-quinazolin-3-yl)acetyl]amino]benzoate Formula: C17H11N4O6- MolecularWeight: 367.29244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O6/c22-15(19-14-4-2-1-3-11(14)17(24)25)8-20-9-18-13-6-5-10(21(26)27)7-12(13)16(20)23/h1-7,9H,8H2,(H,19,22)(H,24,25)/p-1