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

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazole-4-carbonitrile CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazole-4-carbonitrile Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazole-4-carbonitrile Formula: C18H13N3O2 MolecularWeight: 303.31472

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C#N)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C#N)C4=CC=CC=C4

InChI

InChI=1S/C18H13N3O2/c19-11-14-12-21(15-4-2-1-3-5-15)20-18(14)13-6-7-16-17(10-13)23-9-8-22-16/h1-7,10,12H,8-9H2