3-ethyl-3-(1-phenylethyl)imidazol-3-ium-4-carboxylic acid

Systemtic Name: 3-ethyl-3-(1-phenylethyl)imidazol-3-ium-4-carboxylic acid Openeye Name: 3-ethyl-3-(1-phenylethyl)imidazol-3-ium-4-carboxylic acid CAS Name: 3-ethyl-3-(1-phenylethyl)-4-imidazol-3-iumcarboxylic acid IUPAC Name: 3-ethyl-3-(1-phenylethyl)imidazol-3-ium-4-carboxylic acid Traditional Name: 3-ethyl-3-(1-phenylethyl)imidazol-3-ium-4-carboxylic acid Formula: C14H17N2O2+ MolecularWeight: 245.29698

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=NC=C1C(=O)O)C(C)C2=CC=CC=C2

Isomeric SMILES

CC[N+]1(C=NC=C1C(=O)O)C(C)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O2/c1-3-16(10-15-9-13(16)14(17)18)11(2)12-7-5-4-6-8-12/h4-11H,3H2,1-2H3/p+1