2-methoxyethyl 1-(3-piperazin-1-ylphenyl)benzimidazole-5-carboxylate

Systemtic Name: 2-methoxyethyl 1-(3-piperazin-1-ylphenyl)benzimidazole-5-carboxylate Openeye Name: 2-methoxyethyl 1-(3-piperazin-1-ylphenyl)benzimidazole-5-carboxylate CAS Name: 1-[3-(1-piperazinyl)phenyl]-5-benzimidazolecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 1-(3-piperazin-1-ylphenyl)benzimidazole-5-carboxylate Traditional Name: 1-(3-piperazinophenyl)benzimidazole-5-carboxylic acid 2-methoxyethyl ester Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCNCC4

Isomeric SMILES

COCCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCNCC4

InChI

InChI=1S/C21H24N4O3/c1-27-11-12-28-21(26)16-5-6-20-19(13-16)23-15-25(20)18-4-2-3-17(14-18)24-9-7-22-8-10-24/h2-6,13-15,22H,7-12H2,1H3