2-oxidanylidene-6-[2-(4-phenethylpiperazin-1-yl)ethyl]-3H-benzimidazole-1-carboxylic acid

Systemtic Name: 2-oxidanylidene-6-[2-(4-phenethylpiperazin-1-yl)ethyl]-3H-benzimidazole-1-carboxylic acid Openeye Name: 2-oxo-6-[2-(4-phenethylpiperazin-1-yl)ethyl]-3H-benzimidazole-1-carboxylic acid CAS Name: 2-oxo-6-[2-(4-phenethyl-1-piperazinyl)ethyl]-3H-benzimidazole-1-carboxylic acid IUPAC Name: 2-oxo-6-[2-(4-phenethylpiperazin-1-yl)ethyl]-3H-benzimidazole-1-carboxylic acid Traditional Name: 2-keto-6-[2-(4-phenethylpiperazino)ethyl]-3H-benzimidazole-1-carboxylic acid Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)CCC3=CC4=C(C=C3)NC(=O)N4C(=O)O

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)CCC3=CC4=C(C=C3)NC(=O)N4C(=O)O

InChI

InChI=1S/C22H26N4O3/c27-21-23-19-7-6-18(16-20(19)26(21)22(28)29)9-11-25-14-12-24(13-15-25)10-8-17-4-2-1-3-5-17/h1-7,16H,8-15H2,(H,23,27)(H,28,29)