ethyl 3-oxidanyl-3-(6-oxidanyl-2-phenethyl-1H-benzimidazol-4-yl)propanoate hydrochloride

Systemtic Name: ethyl 3-oxidanyl-3-(6-oxidanyl-2-phenethyl-1H-benzimidazol-4-yl)propanoate hydrochloride Openeye Name: ethyl 3-hydroxy-3-(6-hydroxy-2-phenethyl-1H-benzimidazol-4-yl)propanoate hydrochloride CAS Name: 3-hydroxy-3-(6-hydroxy-2-phenethyl-1H-benzimidazol-4-yl)propanoic acid ethyl ester hydrochloride IUPAC Name: ethyl 3-hydroxy-3-(6-hydroxy-2-phenethyl-1H-benzimidazol-4-yl)propanoate hydrochloride Traditional Name: 3-hydroxy-3-(6-hydroxy-2-phenethyl-1H-benzimidazol-4-yl)propionic acid ethyl ester hydrochloride Formula: C20H23ClN2O4 MolecularWeight: 390.86062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC(=CC2=C1N=C(N2)CCC3=CC=CC=C3)O)O.Cl

Isomeric SMILES

CCOC(=O)CC(C1=CC(=CC2=C1N=C(N2)CCC3=CC=CC=C3)O)O.Cl

InChI

InChI=1S/C20H22N2O4.ClH/c1-2-26-19(25)12-17(24)15-10-14(23)11-16-20(15)22-18(21-16)9-8-13-6-4-3-5-7-13;/h3-7,10-11,17,23-24H,2,8-9,12H2,1H3,(H,21,22);1H