2-[(E)-2-[4-(2-piperidin-1-ylethoxy)phenyl]ethenyl]-1H-benzimidazole-4-carboxylic acid

Systemtic Name: 2-[(E)-2-[4-(2-piperidin-1-ylethoxy)phenyl]ethenyl]-1H-benzimidazole-4-carboxylic acid Openeye Name: 2-[(E)-2-[4-[2-(1-piperidyl)ethoxy]phenyl]vinyl]-1H-benzimidazole-4-carboxylic acid CAS Name: 2-[(E)-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]ethenyl]-1H-benzimidazole-4-carboxylic acid IUPAC Name: 2-[(E)-2-[4-(2-piperidin-1-ylethoxy)phenyl]ethenyl]-1H-benzimidazole-4-carboxylic acid Traditional Name: 2-[(E)-2-[4-(2-piperidinoethoxy)phenyl]vinyl]-1H-benzimidazole-4-carboxylic acid Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C=CC3=NC4=C(C=CC=C4N3)C(=O)O

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)/C=C/C3=NC4=C(C=CC=C4N3)C(=O)O

InChI

InChI=1S/C23H25N3O3/c27-23(28)19-5-4-6-20-22(19)25-21(24-20)12-9-17-7-10-18(11-8-17)29-16-15-26-13-2-1-3-14-26/h4-12H,1-3,13-16H2,(H,24,25)(H,27,28)/b12-9+