methyl 4-[3-(2-cyclohex-3-en-1-ylbenzimidazol-1-yl)-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 4-[3-(2-cyclohex-3-en-1-ylbenzimidazol-1-yl)-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 4-[3-(2-cyclohex-3-en-1-ylbenzimidazol-1-yl)-2-hydroxy-propoxy]benzoate CAS Name: 4-[3-[2-(1-cyclohex-3-enyl)-1-benzimidazolyl]-2-hydroxypropoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(2-cyclohex-3-en-1-ylbenzimidazol-1-yl)-2-hydroxypropoxy]benzoate Traditional Name: 4-[3-(2-cyclohex-3-en-1-ylbenzimidazol-1-yl)-2-hydroxy-propoxy]benzoic acid methyl ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(CN2C3=CC=CC=C3N=C2C4CCC=CC4)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(CN2C3=CC=CC=C3N=C2C4CCC=CC4)O

InChI

InChI=1S/C24H26N2O4/c1-29-24(28)18-11-13-20(14-12-18)30-16-19(27)15-26-22-10-6-5-9-21(22)25-23(26)17-7-3-2-4-8-17/h2-3,5-6,9-14,17,19,27H,4,7-8,15-16H2,1H3