1-[4-[(1,3-dimethyl-2H-benzimidazol-2-yl)diazenyl]phenyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[4-[(1,3-dimethyl-2H-benzimidazol-2-yl)diazenyl]phenyl]piperidine-2-carboxylic acid Openeye Name: 1-[4-[(1,3-dimethyl-2H-benzimidazol-2-yl)azo]phenyl]piperidine-2-carboxylic acid CAS Name: 1-[4-[(1,3-dimethyl-2H-benzimidazol-2-yl)azo]phenyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[4-[(1,3-dimethyl-2H-benzimidazol-2-yl)diazenyl]phenyl]piperidine-2-carboxylic acid Traditional Name: 1-[4-[(1,3-dimethyl-2H-benzimidazol-2-yl)azo]phenyl]pipecolinic acid Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(N(C2=CC=CC=C21)C)N=NC3=CC=C(C=C3)N4CCCCC4C(=O)O

Isomeric SMILES

CN1C(N(C2=CC=CC=C21)C)N=NC3=CC=C(C=C3)N4CCCCC4C(=O)O

InChI

InChI=1S/C21H25N5O2/c1-24-17-7-3-4-8-18(17)25(2)21(24)23-22-15-10-12-16(13-11-15)26-14-6-5-9-19(26)20(27)28/h3-4,7-8,10-13,19,21H,5-6,9,14H2,1-2H3,(H,27,28)