ethyl 1-[3,4-bis(phenylcarbonyloxy)-5-(phenylcarbonyloxymethyl)oxolan-2-yl]-6-methyl-pyridin-1-ium-3-carboxylate

Systemtic Name: ethyl 1-[3,4-bis(phenylcarbonyloxy)-5-(phenylcarbonyloxymethyl)oxolan-2-yl]-6-methyl-pyridin-1-ium-3-carboxylate Openeye Name: ethyl 1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)tetrahydrofuran-2-yl]-6-methyl-pyridin-1-ium-3-carboxylate CAS Name: 1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)-2-oxolanyl]-6-methyl-3-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)oxolan-2-yl]-6-methylpyridin-1-ium-3-carboxylate Traditional Name: 1-[3,4-dibenzoyloxy-5-(benzoyloxymethyl)tetrahydrofuran-2-yl]-6-methyl-pyridin-1-ium-3-carboxylic acid ethyl ester Formula: C35H32NO9+ MolecularWeight: 610.62988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[N+](=C(C=C1)C)C2C(C(C(O2)COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C[N+](=C(C=C1)C)C2C(C(C(O2)COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C35H32NO9/c1-3-41-33(38)27-20-19-23(2)36(21-27)31-30(45-35(40)26-17-11-6-12-18-26)29(44-34(39)25-15-9-5-10-16-25)28(43-31)22-42-32(37)24-13-7-4-8-14-24/h4-21,28-31H,3,22H2,1-2H3/q+1