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

Systemtic Name: ethyl 4-[(2R)-3-(5,6-dimethylbenzimidazol-1-yl)-2-oxidanyl-propoxy]benzoate Openeye Name: ethyl 4-[(2R)-3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxy-propoxy]benzoate CAS Name: 4-[(2R)-3-(5,6-dimethyl-1-benzimidazolyl)-2-hydroxypropoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2R)-3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxypropoxy]benzoate Traditional Name: 4-[(2R)-3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxy-propoxy]benzoic acid ethyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC[C@@H](CN2C=NC3=C2C=C(C(=C3)C)C)O

InChI

InChI=1S/C21H24N2O4/c1-4-26-21(25)16-5-7-18(8-6-16)27-12-17(24)11-23-13-22-19-9-14(2)15(3)10-20(19)23/h5-10,13,17,24H,4,11-12H2,1-3H3/t17-/m1/s1