2-[(1-pyridin-3-yl-1,2,3-triazol-4-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(1-pyridin-3-yl-1,2,3-triazol-4-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[[1-(3-pyridyl)triazol-4-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[1-(3-pyridinyl)-4-triazolyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(1-pyridin-3-yltriazol-4-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[[1-(3-pyridyl)triazol-4-yl]methyl]isoindoline-1,3-quinone Formula: C16H11N5O2 MolecularWeight: 305.29084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CN(N=N3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CN(N=N3)C4=CN=CC=C4

InChI

InChI=1S/C16H11N5O2/c22-15-13-5-1-2-6-14(13)16(23)20(15)9-11-10-21(19-18-11)12-4-3-7-17-8-12/h1-8,10H,9H2