N-(4-butylphenyl)-2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-(4-butylphenyl)-2-(7-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-(4-butylphenyl)-2-(7-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-(4-butylphenyl)-2-(7-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(4-butylphenyl)-2-(7-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(4-butylphenyl)-2-(4-keto-7-nitro-quinazolin-3-yl)acetamide Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-2-3-4-14-5-7-15(8-6-14)22-19(25)12-23-13-21-18-11-16(24(27)28)9-10-17(18)20(23)26/h5-11,13H,2-4,12H2,1H3,(H,22,25)