2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-5-nitro-isoindoline-1,3-quinone Formula: C17H9ClN4O5 MolecularWeight: 384.73016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C17H9ClN4O5/c18-8-1-3-11-13(5-8)19-14(20-15(11)23)7-21-16(24)10-4-2-9(22(26)27)6-12(10)17(21)25/h1-6H,7H2,(H,19,20,23)