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

Systemtic Name: 2-[[4-(4-pentylphenyl)-1,2,3-triazol-1-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[4-(4-pentylphenyl)triazol-1-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[4-(4-pentylphenyl)-1-triazolyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[4-(4-pentylphenyl)triazol-1-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[4-(4-amylphenyl)triazol-1-yl]methyl]isoindoline-1,3-quinone Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CN(N=N2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CN(N=N2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H22N4O2/c1-2-3-4-7-16-10-12-17(13-11-16)20-14-25(24-23-20)15-26-21(27)18-8-5-6-9-19(18)22(26)28/h5-6,8-14H,2-4,7,15H2,1H3