2-[2-[4-(2-methylimidazol-1-yl)butyl]phenyl]propanoic acid

Systemtic Name: 2-[2-[4-(2-methylimidazol-1-yl)butyl]phenyl]propanoic acid Openeye Name: 2-[2-[4-(2-methylimidazol-1-yl)butyl]phenyl]propanoic acid CAS Name: 2-[2-[4-(2-methyl-1-imidazolyl)butyl]phenyl]propanoic acid IUPAC Name: 2-[2-[4-(2-methylimidazol-1-yl)butyl]phenyl]propanoic acid Traditional Name: 2-[2-[4-(2-methylimidazol-1-yl)butyl]phenyl]propionic acid Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1CCCCC2=CC=CC=C2C(C)C(=O)O

Isomeric SMILES

CC1=NC=CN1CCCCC2=CC=CC=C2C(C)C(=O)O

InChI

InChI=1S/C17H22N2O2/c1-13(17(20)21)16-9-4-3-7-15(16)8-5-6-11-19-12-10-18-14(19)2/h3-4,7,9-10,12-13H,5-6,8,11H2,1-2H3,(H,20,21)