methyl 2-[3-(benzimidazol-1-yl)propanoylamino]ethanoate hydrochloride

Systemtic Name: methyl 2-[3-(benzimidazol-1-yl)propanoylamino]ethanoate hydrochloride Openeye Name: methyl 2-[3-(benzimidazol-1-yl)propanoylamino]acetate hydrochloride CAS Name: 2-[[3-(1-benzimidazolyl)-1-oxopropyl]amino]acetic acid methyl ester hydrochloride IUPAC Name: methyl 2-[3-(benzimidazol-1-yl)propanoylamino]acetate hydrochloride Traditional Name: 2-[3-(benzimidazol-1-yl)propanoylamino]acetic acid methyl ester hydrochloride Formula: C13H16ClN3O3 MolecularWeight: 297.73744

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CCN1C=NC2=CC=CC=C21.Cl

Isomeric SMILES

COC(=O)CNC(=O)CCN1C=NC2=CC=CC=C21.Cl

InChI

InChI=1S/C13H15N3O3.ClH/c1-19-13(18)8-14-12(17)6-7-16-9-15-10-4-2-3-5-11(10)16;/h2-5,9H,6-8H2,1H3,(H,14,17);1H