5-azanyl-10-nitro-12-oxidanylidene-5,6-dihydroisoquinolino[2,3-a]quinazoline-7-carboxylic acid

Systemtic Name: 5-azanyl-10-nitro-12-oxidanylidene-5,6-dihydroisoquinolino[2,3-a]quinazoline-7-carboxylic acid Openeye Name: 5-amino-10-nitro-12-oxo-5,6-dihydroisoquinolino[2,3-a]quinazoline-7-carboxylic acid CAS Name: 5-amino-10-nitro-12-oxo-5,6-dihydroisoquinolino[2,3-a]quinazoline-7-carboxylic acid IUPAC Name: 5-amino-10-nitro-12-oxo-5,6-dihydroisoquinolino[2,3-a]quinazoline-7-carboxylic acid Traditional Name: 5-amino-12-keto-10-nitro-5,6-dihydroisoquinolino[2,3-a]quinazoline-7-carboxylic acid Formula: C17H12N4O5 MolecularWeight: 352.30098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(NC3=C(C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N23)C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(NC3=C(C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N23)C(=O)O)N

InChI

InChI=1S/C17H12N4O5/c18-14-10-3-1-2-4-12(10)20-15(19-14)13(17(23)24)9-6-5-8(21(25)26)7-11(9)16(20)22/h1-7,14,19H,18H2,(H,23,24)