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

Systemtic Name: [2-(1H-benzimidazol-2-ylmethyl)-3,5,6-trimethyl-4-oxidanyl-phenyl] 3-chloranylbenzoate Openeye Name: [2-(1H-benzimidazol-2-ylmethyl)-4-hydroxy-3,5,6-trimethyl-phenyl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic 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] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [2-(1H-benzimidazol-2-ylmethyl)-4-hydroxy-3,5,6-trimethyl-phenyl] ester Formula: C24H21ClN2O3 MolecularWeight: 420.88814

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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)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C24H21ClN2O3/c1-13-14(2)23(30-24(29)16-7-6-8-17(25)11-16)18(15(3)22(13)28)12-21-26-19-9-4-5-10-20(19)27-21/h4-11,28H,12H2,1-3H3,(H,26,27)