methyl 4-[2-[(3-methoxy-3-oxidanylidene-propyl)carbamoyl]benzimidazol-1-yl]butanoate hydrochloride

Systemtic Name: methyl 4-[2-[(3-methoxy-3-oxidanylidene-propyl)carbamoyl]benzimidazol-1-yl]butanoate hydrochloride Openeye Name: methyl 4-[2-[(3-methoxy-3-oxo-propyl)carbamoyl]benzimidazol-1-yl]butanoate hydrochloride CAS Name: 4-[2-[[(3-methoxy-3-oxopropyl)amino]-oxomethyl]-1-benzimidazolyl]butanoic acid methyl ester hydrochloride IUPAC Name: methyl 4-[2-[(3-methoxy-3-oxopropyl)carbamoyl]benzimidazol-1-yl]butanoate hydrochloride Traditional Name: 4-[2-[(3-keto-3-methoxy-propyl)carbamoyl]benzimidazol-1-yl]butyric acid methyl ester hydrochloride Formula: C17H22ClN3O5 MolecularWeight: 383.82668

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1C2=CC=CC=C2N=C1C(=O)NCCC(=O)OC.Cl

Isomeric SMILES

COC(=O)CCCN1C2=CC=CC=C2N=C1C(=O)NCCC(=O)OC.Cl

InChI

InChI=1S/C17H21N3O5.ClH/c1-24-14(21)8-5-11-20-13-7-4-3-6-12(13)19-16(20)17(23)18-10-9-15(22)25-2;/h3-4,6-7H,5,8-11H2,1-2H3,(H,18,23);1H