1-[[2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrakis(phenylmethoxy)butyl]furan-3-yl]methyl]pyridin-1-ium chloride

Systemtic Name: 1-[[2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrakis(phenylmethoxy)butyl]furan-3-yl]methyl]pyridin-1-ium chloride Openeye Name: 1-[[2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrabenzyloxybutyl]-3-furyl]methyl]pyridin-1-ium chloride CAS Name: 1-[[2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrakis(phenylmethoxy)butyl]-3-furanyl]methyl]pyridin-1-ium chloride IUPAC Name: 1-[[2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrakis(phenylmethoxy)butyl]furan-3-yl]methyl]pyridin-1-ium chloride Traditional Name: 1-[[2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrabenzoxybutyl]-3-furyl]methyl]pyridin-1-ium chloride Formula: C43H44ClNO5 MolecularWeight: 690.26616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(C(C(COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)C[N+]6=CC=CC=C6.[Cl-]

Isomeric SMILES

CC1=C(C=C(O1)[C@H]([C@@H]([C@@H](COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)C[N+]6=CC=CC=C6.[Cl-]

InChI

InChI=1S/C43H44NO5.ClH/c1-34-39(28-44-25-15-6-16-26-44)27-40(49-34)42(47-31-37-21-11-4-12-22-37)43(48-32-38-23-13-5-14-24-38)41(46-30-36-19-9-3-10-20-36)33-45-29-35-17-7-2-8-18-35;/h2-27,41-43H,28-33H2,1H3;1H/q+1;/p-1/t41-,42-,43-;/m1./s1