methyl 2-(benzimidazol-1-ylmethyl)-3-oxidanyl-3-pyridin-4-yl-propanoate

Systemtic Name: methyl 2-(benzimidazol-1-ylmethyl)-3-oxidanyl-3-pyridin-4-yl-propanoate Openeye Name: methyl 2-(benzimidazol-1-ylmethyl)-3-hydroxy-3-(4-pyridyl)propanoate CAS Name: 2-(1-benzimidazolylmethyl)-3-hydroxy-3-pyridin-4-ylpropanoic acid methyl ester IUPAC Name: methyl 2-(benzimidazol-1-ylmethyl)-3-hydroxy-3-pyridin-4-ylpropanoate Traditional Name: 2-(benzimidazol-1-ylmethyl)-3-hydroxy-3-(4-pyridyl)propionic acid methyl ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN1C=NC2=CC=CC=C21)C(C3=CC=NC=C3)O

Isomeric SMILES

COC(=O)C(CN1C=NC2=CC=CC=C21)C(C3=CC=NC=C3)O

InChI

InChI=1S/C17H17N3O3/c1-23-17(22)13(16(21)12-6-8-18-9-7-12)10-20-11-19-14-4-2-3-5-15(14)20/h2-9,11,13,16,21H,10H2,1H3