ethyl 3-[2-[2-(4-hydroxyphenyl)ethyl]-1H-benzimidazol-4-yl]-3-oxidanyl-propanoate

Systemtic Name: ethyl 3-[2-[2-(4-hydroxyphenyl)ethyl]-1H-benzimidazol-4-yl]-3-oxidanyl-propanoate Openeye Name: ethyl 3-hydroxy-3-[2-[2-(4-hydroxyphenyl)ethyl]-1H-benzimidazol-4-yl]propanoate CAS Name: 3-hydroxy-3-[2-[2-(4-hydroxyphenyl)ethyl]-1H-benzimidazol-4-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-3-[2-[2-(4-hydroxyphenyl)ethyl]-1H-benzimidazol-4-yl]propanoate Traditional Name: 3-hydroxy-3-[2-[2-(4-hydroxyphenyl)ethyl]-1H-benzimidazol-4-yl]propionic acid ethyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=C2C(=CC=C1)NC(=N2)CCC3=CC=C(C=C3)O)O

Isomeric SMILES

CCOC(=O)CC(C1=C2C(=CC=C1)NC(=N2)CCC3=CC=C(C=C3)O)O

InChI

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