2-[2-methyl-3-[3-(4-methylphenyl)propyl]imidazol-1-ium-1-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-3-[3-(4-methylphenyl)propyl]imidazol-1-ium-1-yl]ethanoic acid Openeye Name: 2-[2-methyl-3-[3-(p-tolyl)propyl]imidazol-1-ium-1-yl]acetic acid CAS Name: 2-[2-methyl-3-[3-(4-methylphenyl)propyl]-1-imidazol-1-iumyl]acetic acid IUPAC Name: 2-[2-methyl-3-[3-(4-methylphenyl)propyl]imidazol-1-ium-1-yl]acetic acid Traditional Name: 2-[2-methyl-3-[3-(p-tolyl)propyl]imidazol-1-ium-1-yl]acetic acid Formula: C16H21N2O2+ MolecularWeight: 273.35014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCCN2C=C[N+](=C2C)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CCCN2C=C[N+](=C2C)CC(=O)O

InChI

InChI=1S/C16H20N2O2/c1-13-5-7-15(8-6-13)4-3-9-17-10-11-18(14(17)2)12-16(19)20/h5-8,10-11H,3-4,9,12H2,1-2H3/p+1