3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propyl 4-methoxy-3-nitro-benzoate

Systemtic Name: 3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propyl 4-methoxy-3-nitro-benzoate Openeye Name: 3-(2-methyl-4-oxo-quinazolin-3-yl)propyl 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid 3-(2-methyl-4-oxo-3-quinazolinyl)propyl ester IUPAC Name: 3-(2-methyl-4-oxoquinazolin-3-yl)propyl 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid 3-(4-keto-2-methyl-quinazolin-3-yl)propyl ester Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCCOC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCCOC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O6/c1-13-21-16-7-4-3-6-15(16)19(24)22(13)10-5-11-29-20(25)14-8-9-18(28-2)17(12-14)23(26)27/h3-4,6-9,12H,5,10-11H2,1-2H3