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

Systemtic Name: N-[2-[(3,4-dichlorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazolin-8-yl]-4-methyl-pentanamide Openeye Name: N-[2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazolin-8-yl]-4-methyl-pentanamide CAS Name: N-[2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazolin-8-yl]-4-methylpentanamide IUPAC Name: N-[2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazolin-8-yl]-4-methylpentanamide Traditional Name: N-[2-(3,4-dichloroanilino)-4-keto-6-nitro-1H-quinazolin-8-yl]-4-methyl-valeramide Formula: C20H19Cl2N5O4 MolecularWeight: 464.30196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC1=C2C(=CC(=C1)[N+](=O)[O-])C(=O)N=C(N2)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)CCC(=O)NC1=C2C(=CC(=C1)[N+](=O)[O-])C(=O)N=C(N2)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H19Cl2N5O4/c1-10(2)3-6-17(28)24-16-9-12(27(30)31)8-13-18(16)25-20(26-19(13)29)23-11-4-5-14(21)15(22)7-11/h4-5,7-10H,3,6H2,1-2H3,(H,24,28)(H2,23,25,26,29)