3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 5-(4-nitrophenyl)furan-2-carboxylate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 5-(4-nitrophenyl)furan-2-carboxylate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 5-(4-nitrophenyl)furan-2-carboxylate CAS Name: 5-(4-nitrophenyl)-2-furancarboxylic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 5-(4-nitrophenyl)furan-2-carboxylate Traditional Name: 5-(4-nitrophenyl)furan-2-carboxylic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C21H17N3O6 MolecularWeight: 407.37618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2CCCOC(=O)C3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2CCCOC(=O)C3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O6/c25-20(19-11-10-18(30-19)14-6-8-15(9-7-14)24(27)28)29-13-3-12-23-17-5-2-1-4-16(17)22-21(23)26/h1-2,4-11H,3,12-13H2,(H,22,26)