propyl 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-oxidanyl-propoxy]benzoate

Systemtic Name: propyl 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-oxidanyl-propoxy]benzoate Openeye Name: propyl 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxy-propoxy]benzoate CAS Name: 4-[3-(5,6-dimethyl-1-benzimidazolyl)-2-hydroxypropoxy]benzoic acid propyl ester IUPAC Name: propyl 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxypropoxy]benzoate Traditional Name: 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxy-propoxy]benzoic acid propyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=C2C=C(C(=C3)C)C)O

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OCC(CN2C=NC3=C2C=C(C(=C3)C)C)O

InChI

InChI=1S/C22H26N2O4/c1-4-9-27-22(26)17-5-7-19(8-6-17)28-13-18(25)12-24-14-23-20-10-15(2)16(3)11-21(20)24/h5-8,10-11,14,18,25H,4,9,12-13H2,1-3H3