4-[5-azanyl-3-oxidanylidene-4-(4-oxidanylidene-1H-quinazolin-2-yl)-2H-pyrrol-1-yl]benzoate

Systemtic Name: 4-[5-azanyl-3-oxidanylidene-4-(4-oxidanylidene-1H-quinazolin-2-yl)-2H-pyrrol-1-yl]benzoate Openeye Name: 4-[5-amino-3-oxo-4-(4-oxo-1H-quinazolin-2-yl)-2H-pyrrol-1-yl]benzoate CAS Name: 4-[5-amino-3-oxo-4-(4-oxo-1H-quinazolin-2-yl)-2H-pyrrol-1-yl]benzoate IUPAC Name: 4-[5-amino-3-oxo-4-(4-oxo-1H-quinazolin-2-yl)-2H-pyrrol-1-yl]benzoate Traditional Name: 4-[2-amino-4-keto-3-(4-keto-1H-quinazolin-2-yl)-2-pyrrolin-1-yl]benzoate Formula: C19H13N4O4- MolecularWeight: 361.33092

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1C2=CC=C(C=C2)C(=O)[O-])N)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1C(=O)C(=C(N1C2=CC=C(C=C2)C(=O)[O-])N)C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C19H14N4O4/c20-16-15(17-21-13-4-2-1-3-12(13)18(25)22-17)14(24)9-23(16)11-7-5-10(6-8-11)19(26)27/h1-8H,9,20H2,(H,26,27)(H,21,22,25)/p-1