[3-(4-chlorophenyl)carbonyloxy-5-(3-methylpyridin-1-ium-1-yl)oxolan-2-yl]methyl 4-chloranylbenzoate

Systemtic Name: [3-(4-chlorophenyl)carbonyloxy-5-(3-methylpyridin-1-ium-1-yl)oxolan-2-yl]methyl 4-chloranylbenzoate Openeye Name: [3-(4-chlorobenzoyl)oxy-5-(3-methylpyridin-1-ium-1-yl)tetrahydrofuran-2-yl]methyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [3-[(4-chlorophenyl)-oxomethoxy]-5-(3-methyl-1-pyridin-1-iumyl)-2-oxolanyl]methyl ester IUPAC Name: [3-(4-chlorobenzoyl)oxy-5-(3-methylpyridin-1-ium-1-yl)oxolan-2-yl]methyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [3-(4-chlorobenzoyl)oxy-5-(3-methylpyridin-1-ium-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C25H22Cl2NO5+ MolecularWeight: 487.35188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C2CC(C(O2)COC(=O)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C[N+](=CC=C1)C2CC(C(O2)COC(=O)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H22Cl2NO5/c1-16-3-2-12-28(14-16)23-13-21(33-25(30)18-6-10-20(27)11-7-18)22(32-23)15-31-24(29)17-4-8-19(26)9-5-17/h2-12,14,21-23H,13,15H2,1H3/q+1