2-[(Z)-1-chloranyl-2-[5-(4-nitrophenyl)furan-2-yl]ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid

Systemtic Name: 2-[(Z)-1-chloranyl-2-[5-(4-nitrophenyl)furan-2-yl]ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid Openeye Name: 2-[(Z)-1-chloro-2-[5-(4-nitrophenyl)-2-furyl]vinyl]-4-oxo-1H-quinazoline-7-carboxylic acid CAS Name: 2-[(Z)-1-chloro-2-[5-(4-nitrophenyl)-2-furanyl]ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid IUPAC Name: 2-[(Z)-1-chloro-2-[5-(4-nitrophenyl)furan-2-yl]ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid Traditional Name: 2-[(Z)-1-chloro-2-[5-(4-nitrophenyl)-2-furyl]vinyl]-4-keto-1H-quinazoline-7-carboxylic acid Formula: C21H12ClN3O6 MolecularWeight: 437.78948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)C=C(C3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)/C=C(/C3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)O)\Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H12ClN3O6/c22-16(19-23-17-9-12(21(27)28)3-7-15(17)20(26)24-19)10-14-6-8-18(31-14)11-1-4-13(5-2-11)25(29)30/h1-10H,(H,27,28)(H,23,24,26)/b16-10-