3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 5-bromanylpyridine-3-carboxylate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 5-bromanylpyridine-3-carboxylate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C16H14BrN3O3 MolecularWeight: 376.20466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2CCCOC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2CCCOC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H14BrN3O3/c17-12-8-11(9-18-10-12)15(21)23-7-3-6-20-14-5-2-1-4-13(14)19-16(20)22/h1-2,4-5,8-10H,3,6-7H2,(H,19,22)