methyl 4-[3-(benzimidazol-1-yl)-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 4-[3-(benzimidazol-1-yl)-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 4-[3-(benzimidazol-1-yl)-2-hydroxy-propoxy]benzoate CAS Name: 4-[3-(1-benzimidazolyl)-2-hydroxypropoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(benzimidazol-1-yl)-2-hydroxypropoxy]benzoate Traditional Name: 4-[3-(benzimidazol-1-yl)-2-hydroxy-propoxy]benzoic acid methyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=CC=CC=C32)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=CC=CC=C32)O

InChI

InChI=1S/C18H18N2O4/c1-23-18(22)13-6-8-15(9-7-13)24-11-14(21)10-20-12-19-16-4-2-3-5-17(16)20/h2-9,12,14,21H,10-11H2,1H3