(2-chloranyl-4-nitro-phenyl) 3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanoate Openeye Name: (2-chloro-4-nitro-phenyl) 3-(3-methyl-2-oxo-benzimidazol-1-yl)propanoate CAS Name: 3-(3-methyl-2-oxo-1-benzimidazolyl)propanoic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 3-(3-methyl-2-oxobenzimidazol-1-yl)propanoate Traditional Name: 3-(2-keto-3-methyl-benzimidazol-1-yl)propionic acid (2-chloro-4-nitro-phenyl) ester Formula: C17H14ClN3O5 MolecularWeight: 375.76316

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H14ClN3O5/c1-19-13-4-2-3-5-14(13)20(17(19)23)9-8-16(22)26-15-7-6-11(21(24)25)10-12(15)18/h2-7,10H,8-9H2,1H3