N-[(4-methylphenyl)methyl]-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)-N-propyl-ethanamide

Systemtic Name: N-[(4-methylphenyl)methyl]-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)-N-propyl-ethanamide Openeye Name: 2-(6-nitro-4-oxo-quinazolin-3-yl)-N-propyl-N-(p-tolylmethyl)acetamide CAS Name: N-[(4-methylphenyl)methyl]-2-(6-nitro-4-oxo-3-quinazolinyl)-N-propylacetamide IUPAC Name: N-[(4-methylphenyl)methyl]-2-(6-nitro-4-oxoquinazolin-3-yl)-N-propylacetamide Traditional Name: 2-(4-keto-6-nitro-quinazolin-3-yl)-N-(4-methylbenzyl)-N-propyl-acetamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)C)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)C)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O4/c1-3-10-23(12-16-6-4-15(2)5-7-16)20(26)13-24-14-22-19-9-8-17(25(28)29)11-18(19)21(24)27/h4-9,11,14H,3,10,12-13H2,1-2H3