(4-azanylquinazolin-2-yl)methyl 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 2-(4-chloro-3-nitro-benzoyl)benzoate CAS Name: 2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 2-(4-chloro-3-nitrobenzoyl)benzoate Traditional Name: 2-(4-chloro-3-nitro-benzoyl)benzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C23H15ClN4O5 MolecularWeight: 462.842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC=CC=C3C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC=CC=C3C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C23H15ClN4O5/c24-17-10-9-13(11-19(17)28(31)32)21(29)14-5-1-2-6-15(14)23(30)33-12-20-26-18-8-4-3-7-16(18)22(25)27-20/h1-11H,12H2,(H2,25,26,27)