methyl 5-[8,9-bis(chloranyl)-2-methyl-12-oxidanylidene-benzimidazolo[2,3-b]quinazolin-6-yl]-3-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[8,9-bis(chloranyl)-2-methyl-12-oxidanylidene-benzimidazolo[2,3-b]quinazolin-6-yl]-3-oxidanylidene-pentanoate Openeye Name: methyl 5-(8,9-dichloro-2-methyl-12-oxo-benzimidazolo[2,3-b]quinazolin-6-yl)-3-oxo-pentanoate CAS Name: 5-(8,9-dichloro-2-methyl-12-oxo-6-benzimidazolo[2,3-b]quinazolinyl)-3-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(8,9-dichloro-2-methyl-12-oxobenzimidazolo[2,3-b]quinazolin-6-yl)-3-oxopentanoate Traditional Name: 5-(8,9-dichloro-12-keto-2-methyl-benzimidazolo[2,3-b]quinazolin-6-yl)-3-keto-valeric acid methyl ester Formula: C21H17Cl2N3O4 MolecularWeight: 446.28338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C3N(C4=CC(=C(C=C4N3C2=O)Cl)Cl)CCC(=O)CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C3N(C4=CC(=C(C=C4N3C2=O)Cl)Cl)CCC(=O)CC(=O)OC

InChI

InChI=1S/C21H17Cl2N3O4/c1-11-3-4-16-13(7-11)20(29)26-18-10-15(23)14(22)9-17(18)25(21(26)24-16)6-5-12(27)8-19(28)30-2/h3-4,7,9-10H,5-6,8H2,1-2H3