2-[4-[6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-phenyl]ethanenitrile

Systemtic Name: 2-[4-[6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-phenyl]ethanenitrile Openeye Name: 2-[3-hydroxy-4-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-phenyl]acetonitrile CAS Name: 2-[3-hydroxy-4-[(3,4,5-trihydroxy-6-methyl-2-oxanyl)oxy]phenyl]acetonitrile IUPAC Name: 2-[3-hydroxy-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyphenyl]acetonitrile Traditional Name: 2-[3-hydroxy-4-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-phenyl]acetonitrile Formula: C14H17NO6 MolecularWeight: 295.28788

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2=C(C=C(C=C2)CC#N)O)O)O)O

Isomeric SMILES

CC1C(C(C(C(O1)OC2=C(C=C(C=C2)CC#N)O)O)O)O

InChI

InChI=1S/C14H17NO6/c1-7-11(17)12(18)13(19)14(20-7)21-10-3-2-8(4-5-15)6-9(10)16/h2-3,6-7,11-14,16-19H,4H2,1H3