3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propyl 4-nitrobenzoate

Systemtic Name: 3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propyl 4-nitrobenzoate Openeye Name: 3-(2-methyl-4-oxo-quinazolin-3-yl)propyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 3-(2-methyl-4-oxo-3-quinazolinyl)propyl ester IUPAC Name: 3-(2-methyl-4-oxoquinazolin-3-yl)propyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 3-(4-keto-2-methyl-quinazolin-3-yl)propyl ester Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O5/c1-13-20-17-6-3-2-5-16(17)18(23)21(13)11-4-12-27-19(24)14-7-9-15(10-8-14)22(25)26/h2-3,5-10H,4,11-12H2,1H3