N-butyl-3-methyl-4-nitro-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide

Systemtic Name: N-butyl-3-methyl-4-nitro-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide Openeye Name: N-butyl-3-methyl-4-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide CAS Name: N-butyl-3-methyl-4-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide IUPAC Name: N-butyl-3-methyl-4-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide Traditional Name: N-butyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]-3-methyl-4-nitro-benzamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H22N4O4/c1-3-4-11-24(21(27)15-9-10-18(25(28)29)14(2)12-15)13-19-22-17-8-6-5-7-16(17)20(26)23-19/h5-10,12H,3-4,11,13H2,1-2H3,(H,22,23,26)