5-(1,3-benzodioxol-5-yl)-3-(pyridin-2-ylmethyl)-1,2,3-triazole-4-carbonitrile

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-3-(pyridin-2-ylmethyl)-1,2,3-triazole-4-carbonitrile Openeye Name: 5-(1,3-benzodioxol-5-yl)-3-(2-pyridylmethyl)triazole-4-carbonitrile CAS Name: 5-(1,3-benzodioxol-5-yl)-3-(2-pyridinylmethyl)-4-triazolecarbonitrile IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3-(pyridin-2-ylmethyl)triazole-4-carbonitrile Traditional Name: 5-(1,3-benzodioxol-5-yl)-3-(2-pyridylmethyl)triazole-4-carbonitrile Formula: C16H11N5O2 MolecularWeight: 305.29084

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(N(N=N3)CC4=CC=CC=N4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(N(N=N3)CC4=CC=CC=N4)C#N

InChI

InChI=1S/C16H11N5O2/c17-8-13-16(11-4-5-14-15(7-11)23-10-22-14)19-20-21(13)9-12-3-1-2-6-18-12/h1-7H,9-10H2