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

Systemtic Name: methyl 3-[2-oxidanyl-3-(2-phenethylbenzimidazol-1-yl)propoxy]benzoate Openeye Name: methyl 3-[2-hydroxy-3-(2-phenethylbenzimidazol-1-yl)propoxy]benzoate CAS Name: 3-[2-hydroxy-3-(2-phenethyl-1-benzimidazolyl)propoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-hydroxy-3-(2-phenethylbenzimidazol-1-yl)propoxy]benzoate Traditional Name: 3-[2-hydroxy-3-(2-phenethylbenzimidazol-1-yl)propoxy]benzoic acid methyl ester Formula: C26H26N2O4 MolecularWeight: 430.49564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCC(CN2C3=CC=CC=C3N=C2CCC4=CC=CC=C4)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OCC(CN2C3=CC=CC=C3N=C2CCC4=CC=CC=C4)O

InChI

InChI=1S/C26H26N2O4/c1-31-26(30)20-10-7-11-22(16-20)32-18-21(29)17-28-24-13-6-5-12-23(24)27-25(28)15-14-19-8-3-2-4-9-19/h2-13,16,21,29H,14-15,17-18H2,1H3