2-[4-[(4-ethylphenyl)methyl]-5-methyl-1-prop-2-enyl-pyrazol-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Systemtic Name: 2-[4-[(4-ethylphenyl)methyl]-5-methyl-1-prop-2-enyl-pyrazol-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol Openeye Name: 2-[1-allyl-4-[(4-ethylphenyl)methyl]-5-methyl-pyrazol-3-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: 2-[[4-[(4-ethylphenyl)methyl]-5-methyl-1-prop-2-enyl-3-pyrazolyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol IUPAC Name: 2-[4-[(4-ethylphenyl)methyl]-5-methyl-1-prop-2-enylpyrazol-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: 2-[1-allyl-4-(4-ethylbenzyl)-5-methyl-pyrazol-3-yl]oxy-6-methylol-tetrahydropyran-3,4,5-triol Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=C(N(N=C2OC3C(C(C(C(O3)CO)O)O)O)CC=C)C

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=C(N(N=C2OC3C(C(C(C(O3)CO)O)O)O)CC=C)C

InChI

InChI=1S/C22H30N2O6/c1-4-10-24-13(3)16(11-15-8-6-14(5-2)7-9-15)21(23-24)30-22-20(28)19(27)18(26)17(12-25)29-22/h4,6-9,17-20,22,25-28H,1,5,10-12H2,2-3H3