1-[3-(3,5-dimethylpiperazin-1-yl)phenyl]-2-(1-methoxyethyl)benzimidazole-5-carboxylic acid

Systemtic Name: 1-[3-(3,5-dimethylpiperazin-1-yl)phenyl]-2-(1-methoxyethyl)benzimidazole-5-carboxylic acid Openeye Name: 1-[3-(3,5-dimethylpiperazin-1-yl)phenyl]-2-(1-methoxyethyl)benzimidazole-5-carboxylic acid CAS Name: 1-[3-(3,5-dimethyl-1-piperazinyl)phenyl]-2-(1-methoxyethyl)-5-benzimidazolecarboxylic acid IUPAC Name: 1-[3-(3,5-dimethylpiperazin-1-yl)phenyl]-2-(1-methoxyethyl)benzimidazole-5-carboxylic acid Traditional Name: 1-[3-(3,5-dimethylpiperazino)phenyl]-2-(1-methoxyethyl)benzimidazole-5-carboxylic acid Formula: C23H28N4O3 MolecularWeight: 408.49342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=CC=CC(=C2)N3C4=C(C=C(C=C4)C(=O)O)N=C3C(C)OC

Isomeric SMILES

CC1CN(CC(N1)C)C2=CC=CC(=C2)N3C4=C(C=C(C=C4)C(=O)O)N=C3C(C)OC

InChI

InChI=1S/C23H28N4O3/c1-14-12-26(13-15(2)24-14)18-6-5-7-19(11-18)27-21-9-8-17(23(28)29)10-20(21)25-22(27)16(3)30-4/h5-11,14-16,24H,12-13H2,1-4H3,(H,28,29)