[2-(1H-benzimidazol-2-ylmethyl)-3,5,6-trimethyl-4-oxidanyl-phenyl] benzoate

Systemtic Name: [2-(1H-benzimidazol-2-ylmethyl)-3,5,6-trimethyl-4-oxidanyl-phenyl] benzoate Openeye Name: [2-(1H-benzimidazol-2-ylmethyl)-4-hydroxy-3,5,6-trimethyl-phenyl] benzoate CAS Name: benzoic acid [2-(1H-benzimidazol-2-ylmethyl)-4-hydroxy-3,5,6-trimethylphenyl] ester IUPAC Name: [2-(1H-benzimidazol-2-ylmethyl)-4-hydroxy-3,5,6-trimethylphenyl] benzoate Traditional Name: benzoic acid [2-(1H-benzimidazol-2-ylmethyl)-4-hydroxy-3,5,6-trimethyl-phenyl] ester Formula: C24H22N2O3 MolecularWeight: 386.44308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1O)C)CC2=NC3=CC=CC=C3N2)OC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=C(C(=C1O)C)CC2=NC3=CC=CC=C3N2)OC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C24H22N2O3/c1-14-15(2)23(29-24(28)17-9-5-4-6-10-17)18(16(3)22(14)27)13-21-25-19-11-7-8-12-20(19)26-21/h4-12,27H,13H2,1-3H3,(H,25,26)