(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate CAS Name: 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoate Traditional Name: 2-[(2-chlorobenzyl)amino]-5-nitro-benzoic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C23H16Cl2N4O5 MolecularWeight: 499.30294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H16Cl2N4O5/c24-14-5-7-16-20(9-14)27-21(28-22(16)30)12-34-23(31)17-10-15(29(32)33)6-8-19(17)26-11-13-3-1-2-4-18(13)25/h1-10,26H,11-12H2,(H,27,28,30)