2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl 2-(4-chloranylphenoxy)ethanoate

Systemtic Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl 2-(4-chloranylphenoxy)ethanoate Openeye Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl 2-(4-chlorophenoxy)acetate CAS Name: 2-(4-chlorophenoxy)acetic acid 2-(2,4,6-trimethyl-1-pyridin-1-iumyl)ethyl ester IUPAC Name: 2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl 2-(4-chlorophenoxy)acetate Traditional Name: 2-(4-chlorophenoxy)acetic acid 2-(2,4,6-trimethylpyridin-1-ium-1-yl)ethyl ester Formula: C18H21ClNO3+ MolecularWeight: 334.81724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C(=C1)C)CCOC(=O)COC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=[N+](C(=C1)C)CCOC(=O)COC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C18H21ClNO3/c1-13-10-14(2)20(15(3)11-13)8-9-22-18(21)12-23-17-6-4-16(19)5-7-17/h4-7,10-11H,8-9,12H2,1-3H3/q+1