5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxyethyl)pyrazole-3-carbonitrile

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxyethyl)pyrazole-3-carbonitrile Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxyethyl)pyrazole-3-carbonitrile CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxyethyl)-3-pyrazolecarbonitrile IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxyethyl)pyrazole-3-carbonitrile Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(2-hydroxyethyl)pyrazole-3-carbonitrile Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=CC(=NN3CCO)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=CC(=NN3CCO)C#N

InChI

InChI=1S/C14H13N3O3/c15-9-11-8-12(17(16-11)3-4-18)10-1-2-13-14(7-10)20-6-5-19-13/h1-2,7-8,18H,3-6H2