3-(1-propan-2-ylbenzimidazol-2-yl)propanoic acid

Systemtic Name: 3-(1-propan-2-ylbenzimidazol-2-yl)propanoic acid Openeye Name: 3-(1-isopropylbenzimidazol-2-yl)propanoic acid CAS Name: 3-(1-propan-2-yl-2-benzimidazolyl)propanoic acid IUPAC Name: 3-(1-propan-2-ylbenzimidazol-2-yl)propanoic acid Traditional Name: 3-(1-isopropylbenzimidazol-2-yl)propionic acid Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2N=C1CCC(=O)O

Isomeric SMILES

CC(C)N1C2=CC=CC=C2N=C1CCC(=O)O

InChI

InChI=1S/C13H16N2O2/c1-9(2)15-11-6-4-3-5-10(11)14-12(15)7-8-13(16)17/h3-6,9H,7-8H2,1-2H3,(H,16,17)