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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCCN2C(=NC3=CC=CC=C3C2=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCCN2C(=NC3=CC=CC=C3C2=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O5/c1-12-7-8-14(11-17(12)22(25)26)19(24)27-10-9-21-13(2)20-16-6-4-3-5-15(16)18(21)23/h3-8,11H,9-10H2,1-2H3