3-azanyl-5-[(E)-2-(1,3-benzodioxol-5-yl)-1-cyano-ethenyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[(E)-2-(1,3-benzodioxol-5-yl)-1-cyano-ethenyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[(E)-2-(1,3-benzodioxol-5-yl)-1-cyano-vinyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[(E)-2-(1,3-benzodioxol-5-yl)-1-cyanoethenyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[(E)-2-(1,3-benzodioxol-5-yl)-1-cyanoethenyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[(E)-2-(1,3-benzodioxol-5-yl)-1-cyano-vinyl]-1H-pyrazole-4-carbonitrile Formula: C14H9N5O2 MolecularWeight: 279.25356

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C#N)C3=C(C(=NN3)N)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(/C#N)\C3=C(C(=NN3)N)C#N

InChI

InChI=1S/C14H9N5O2/c15-5-9(13-10(6-16)14(17)19-18-13)3-8-1-2-11-12(4-8)21-7-20-11/h1-4H,7H2,(H3,17,18,19)/b9-3-