1-[4-[[5-(dimethylamino)-1,3-dimethyl-2H-benzimidazol-2-yl]diazenyl]phenyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[4-[[5-(dimethylamino)-1,3-dimethyl-2H-benzimidazol-2-yl]diazenyl]phenyl]piperidine-2-carboxylic acid Openeye Name: 1-[4-[[5-(dimethylamino)-1,3-dimethyl-2H-benzimidazol-2-yl]azo]phenyl]piperidine-2-carboxylic acid CAS Name: 1-[4-[[5-(dimethylamino)-1,3-dimethyl-2H-benzimidazol-2-yl]azo]phenyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[4-[[5-(dimethylamino)-1,3-dimethyl-2H-benzimidazol-2-yl]diazenyl]phenyl]piperidine-2-carboxylic acid Traditional Name: 1-[4-[[5-(dimethylamino)-1,3-dimethyl-2H-benzimidazol-2-yl]azo]phenyl]pipecolinic acid Formula: C23H30N6O2 MolecularWeight: 422.5233

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(N(C2=C1C=CC(=C2)N(C)C)C)N=NC3=CC=C(C=C3)N4CCCCC4C(=O)O

Isomeric SMILES

CN1C(N(C2=C1C=CC(=C2)N(C)C)C)N=NC3=CC=C(C=C3)N4CCCCC4C(=O)O

InChI

InChI=1S/C23H30N6O2/c1-26(2)18-12-13-19-21(15-18)28(4)23(27(19)3)25-24-16-8-10-17(11-9-16)29-14-6-5-7-20(29)22(30)31/h8-13,15,20,23H,5-7,14H2,1-4H3,(H,30,31)