4-[[3-[(E)-2-(1-methylbenzimidazol-2-yl)ethenyl]phenyl]amino]butanoic acid

Systemtic Name: 4-[[3-[(E)-2-(1-methylbenzimidazol-2-yl)ethenyl]phenyl]amino]butanoic acid Openeye Name: 4-[3-[(E)-2-(1-methylbenzimidazol-2-yl)vinyl]anilino]butanoic acid CAS Name: 4-[3-[(E)-2-(1-methyl-2-benzimidazolyl)ethenyl]anilino]butanoic acid IUPAC Name: 4-[3-[(E)-2-(1-methylbenzimidazol-2-yl)ethenyl]anilino]butanoic acid Traditional Name: 4-[3-[(E)-2-(1-methylbenzimidazol-2-yl)vinyl]anilino]butyric acid Formula: C20H21N3O2 MolecularWeight: 335.39964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C=CC3=CC(=CC=C3)NCCCC(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2N=C1/C=C/C3=CC(=CC=C3)NCCCC(=O)O

InChI

InChI=1S/C20H21N3O2/c1-23-18-9-3-2-8-17(18)22-19(23)12-11-15-6-4-7-16(14-15)21-13-5-10-20(24)25/h2-4,6-9,11-12,14,21H,5,10,13H2,1H3,(H,24,25)/b12-11+