ethyl 3-[[2-chloranyl-4-[methyl(pentyl)amino]phenyl]methyl]-2-methyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 3-[[2-chloranyl-4-[methyl(pentyl)amino]phenyl]methyl]-2-methyl-benzimidazole-5-carboxylate Openeye Name: ethyl 3-[[2-chloro-4-[methyl(pentyl)amino]phenyl]methyl]-2-methyl-benzimidazole-5-carboxylate CAS Name: 3-[[2-chloro-4-[methyl(pentyl)amino]phenyl]methyl]-2-methyl-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-chloro-4-[methyl(pentyl)amino]phenyl]methyl]-2-methylbenzimidazole-5-carboxylate Traditional Name: 3-[4-[amyl(methyl)amino]-2-chloro-benzyl]-2-methyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C24H30ClN3O2 MolecularWeight: 427.9669

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C)C1=CC(=C(C=C1)CN2C(=NC3=C2C=C(C=C3)C(=O)OCC)C)Cl

Isomeric SMILES

CCCCCN(C)C1=CC(=C(C=C1)CN2C(=NC3=C2C=C(C=C3)C(=O)OCC)C)Cl

InChI

InChI=1S/C24H30ClN3O2/c1-5-7-8-13-27(4)20-11-9-19(21(25)15-20)16-28-17(3)26-22-12-10-18(14-23(22)28)24(29)30-6-2/h9-12,14-15H,5-8,13,16H2,1-4H3