[3,4,5-triacetyloxy-6-[2-methoxy-4-(3-piperidin-1-ium-1-ylpropylcarbamoyl)phenoxy]oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-[2-methoxy-4-(3-piperidin-1-ium-1-ylpropylcarbamoyl)phenoxy]oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-[2-methoxy-4-(3-piperidin-1-ium-1-ylpropylcarbamoyl)phenoxy]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[2-methoxy-4-[oxo-[3-(1-piperidin-1-iumyl)propylamino]methyl]phenoxy]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-[2-methoxy-4-(3-piperidin-1-ium-1-ylpropylcarbamoyl)phenoxy]oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-[2-methoxy-4-(3-piperidin-1-ium-1-ylpropylcarbamoyl)phenoxy]tetrahydropyran-2-yl]methyl ester Formula: C30H43N2O12+ MolecularWeight: 623.66862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C(=O)NCCC[NH+]3CCCCC3)OC)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)C(=O)NCCC[NH+]3CCCCC3)OC)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C30H42N2O12/c1-18(33)39-17-25-26(40-19(2)34)27(41-20(3)35)28(42-21(4)36)30(44-25)43-23-11-10-22(16-24(23)38-5)29(37)31-12-9-15-32-13-7-6-8-14-32/h10-11,16,25-28,30H,6-9,12-15,17H2,1-5H3,(H,31,37)/p+1