3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(4-chloranyl-2-nitro-phenyl)propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-(4-chloranyl-2-nitro-phenyl)propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-(4-chloro-2-nitro-phenyl)propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-(4-chloro-2-nitrophenyl)propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-(4-chloro-2-nitrophenyl)propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-(4-chloro-2-nitro-phenyl)propionamide Formula: C17H12BrClN4O4 MolecularWeight: 451.65858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)[N+](=O)[O-])NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

C1=CC(=C(C=C1Cl)[N+](=O)[O-])NC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C17H12BrClN4O4/c18-10-1-3-13-12(7-10)17(25)22(9-20-13)6-5-16(24)21-14-4-2-11(19)8-15(14)23(26)27/h1-4,7-9H,5-6H2,(H,21,24)