N-[2-[(3,4-dichlorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazolin-8-yl]-2-methyl-benzamide

Systemtic Name: N-[2-[(3,4-dichlorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazolin-8-yl]-2-methyl-benzamide Openeye Name: N-[2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazolin-8-yl]-2-methyl-benzamide CAS Name: N-[2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazolin-8-yl]-2-methylbenzamide IUPAC Name: N-[2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazolin-8-yl]-2-methylbenzamide Traditional Name: N-[2-(3,4-dichloroanilino)-4-keto-6-nitro-1H-quinazolin-8-yl]-2-methyl-benzamide Formula: C22H15Cl2N5O4 MolecularWeight: 484.2916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H15Cl2N5O4/c1-11-4-2-3-5-14(11)20(30)26-18-10-13(29(32)33)9-15-19(18)27-22(28-21(15)31)25-12-6-7-16(23)17(24)8-12/h2-10H,1H3,(H,26,30)(H2,25,27,28,31)