ethyl 6-[3-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]imidazol-3-ium-1-yl]hexanoate

Systemtic Name: ethyl 6-[3-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]imidazol-3-ium-1-yl]hexanoate Openeye Name: ethyl 6-[3-[2-(4-chlorophenyl)-2-oxo-ethyl]imidazol-3-ium-1-yl]hexanoate CAS Name: 6-[3-[2-(4-chlorophenyl)-2-oxoethyl]-1-imidazol-3-iumyl]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[3-[2-(4-chlorophenyl)-2-oxoethyl]imidazol-3-ium-1-yl]hexanoate Traditional Name: 6-[3-[2-(4-chlorophenyl)-2-keto-ethyl]imidazol-3-ium-1-yl]hexanoic acid ethyl ester Formula: C19H24ClN2O3+ MolecularWeight: 363.85846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCN1C=C[N+](=C1)CC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)CCCCCN1C=C[N+](=C1)CC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H24ClN2O3/c1-2-25-19(24)6-4-3-5-11-21-12-13-22(15-21)14-18(23)16-7-9-17(20)10-8-16/h7-10,12-13,15H,2-6,11,14H2,1H3/q+1