(2-chloranyl-4-nitro-phenyl) 3-(4-oxidanylidenequinazolin-3-yl)propanoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 3-(4-oxidanylidenequinazolin-3-yl)propanoate Openeye Name: (2-chloro-4-nitro-phenyl) 3-(4-oxoquinazolin-3-yl)propanoate CAS Name: 3-(4-oxo-3-quinazolinyl)propanoic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 3-(4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-ketoquinazolin-3-yl)propionic acid (2-chloro-4-nitro-phenyl) ester Formula: C17H12ClN3O5 MolecularWeight: 373.74728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12ClN3O5/c18-13-9-11(21(24)25)5-6-15(13)26-16(22)7-8-20-10-19-14-4-2-1-3-12(14)17(20)23/h1-6,9-10H,7-8H2