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

Systemtic Name: N-butyl-4-chloranyl-3-nitro-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide Openeye Name: N-butyl-4-chloro-3-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide CAS Name: N-butyl-4-chloro-3-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide IUPAC Name: N-butyl-4-chloro-3-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide Traditional Name: N-butyl-4-chloro-N-[(4-keto-1H-quinazolin-2-yl)methyl]-3-nitro-benzamide Formula: C20H19ClN4O4 MolecularWeight: 414.84226

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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)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN4O4/c1-2-3-10-24(20(27)13-8-9-15(21)17(11-13)25(28)29)12-18-22-16-7-5-4-6-14(16)19(26)23-18/h4-9,11H,2-3,10,12H2,1H3,(H,22,23,26)