[6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 3-acetamidobenzoate

Systemtic Name: [6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 3-acetamidobenzoate Openeye Name: [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [6-chloro-1-(2-hydroxyethyl)-2-benzimidazolyl]methyl ester IUPAC Name: [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl ester Formula: C19H18ClN3O4 MolecularWeight: 387.81692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=NC3=C(N2CCO)C=C(C=C3)Cl

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=NC3=C(N2CCO)C=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3O4/c1-12(25)21-15-4-2-3-13(9-15)19(26)27-11-18-22-16-6-5-14(20)10-17(16)23(18)7-8-24/h2-6,9-10,24H,7-8,11H2,1H3,(H,21,25)