(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethanoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-[(4-chloro-3-nitro-benzoyl)amino]acetate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]acetic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-[(4-chloro-3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)amino]acetic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C18H12Cl2N4O6 MolecularWeight: 451.21708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCC(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCC(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H12Cl2N4O6/c19-10-2-3-11-13(6-10)22-15(23-18(11)27)8-30-16(25)7-21-17(26)9-1-4-12(20)14(5-9)24(28)29/h1-6H,7-8H2,(H,21,26)(H,22,23,27)