methyl 4-(2-chloranyl-4-nitro-phenoxy)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-(2-chloranyl-4-nitro-phenoxy)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butanoate Openeye Name: methyl 4-(2-chloro-4-nitro-phenoxy)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-butanoate CAS Name: 4-(2-chloro-4-nitrophenoxy)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(2-chloro-4-nitrophenoxy)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutanoate Traditional Name: 4-(2-chloro-4-nitro-phenoxy)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-butyric acid methyl ester Formula: C18H14ClN3O6 MolecularWeight: 403.77326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H14ClN3O6/c1-27-18(24)16(17-20-12-4-2-3-5-13(12)21-17)14(23)9-28-15-7-6-10(22(25)26)8-11(15)19/h2-8,20-21H,9H2,1H3