[6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 2,3-dimethyl-1H-indole-5-carboxylate

Systemtic Name: [6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 2,3-dimethyl-1H-indole-5-carboxylate Openeye Name: [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 2,3-dimethyl-1H-indole-5-carboxylate CAS Name: 2,3-dimethyl-1H-indole-5-carboxylic acid [6-chloro-1-(2-hydroxyethyl)-2-benzimidazolyl]methyl ester IUPAC Name: [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 2,3-dimethyl-1H-indole-5-carboxylate Traditional Name: 2,3-dimethyl-1H-indole-5-carboxylic acid [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl ester Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)OCC3=NC4=C(N3CCO)C=C(C=C4)Cl)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)OCC3=NC4=C(N3CCO)C=C(C=C4)Cl)C

InChI

InChI=1S/C21H20ClN3O3/c1-12-13(2)23-17-5-3-14(9-16(12)17)21(27)28-11-20-24-18-6-4-15(22)10-19(18)25(20)7-8-26/h3-6,9-10,23,26H,7-8,11H2,1-2H3