ethyl 2-butyl-1-chloranyl-4-cyano-3-methyl-pyrido[1,2-a]benzimidazole-7-carboxylate

Systemtic Name: ethyl 2-butyl-1-chloranyl-4-cyano-3-methyl-pyrido[1,2-a]benzimidazole-7-carboxylate Openeye Name: ethyl 2-butyl-1-chloro-4-cyano-3-methyl-pyrido[1,2-a]benzimidazole-7-carboxylate CAS Name: 2-butyl-1-chloro-4-cyano-3-methyl-7-pyrido[1,2-a]benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-1-chloro-4-cyano-3-methylpyrido[1,2-a]benzimidazole-7-carboxylate Traditional Name: 2-butyl-1-chloro-4-cyano-3-methyl-pyrido[1,2-a]benzimidazole-7-carboxylic acid ethyl ester Formula: C20H20ClN3O2 MolecularWeight: 369.8447

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N2C3=C(C=C(C=C3)C(=O)OCC)N=C2C(=C1C)C#N)Cl

Isomeric SMILES

CCCCC1=C(N2C3=C(C=C(C=C3)C(=O)OCC)N=C2C(=C1C)C#N)Cl

InChI

InChI=1S/C20H20ClN3O2/c1-4-6-7-14-12(3)15(11-22)19-23-16-10-13(20(25)26-5-2)8-9-17(16)24(19)18(14)21/h8-10H,4-7H2,1-3H3