2-[3-[(4-methylphenyl)methyl]-5-oxidanylidene-1H-1,2,4-triazol-4-yl]isoindole-1,3-dione

Systemtic Name: 2-[3-[(4-methylphenyl)methyl]-5-oxidanylidene-1H-1,2,4-triazol-4-yl]isoindole-1,3-dione Openeye Name: 2-[5-oxo-3-(p-tolylmethyl)-1H-1,2,4-triazol-4-yl]isoindoline-1,3-dione CAS Name: 2-[3-[(4-methylphenyl)methyl]-5-oxo-1H-1,2,4-triazol-4-yl]isoindole-1,3-dione IUPAC Name: 2-[3-[(4-methylphenyl)methyl]-5-oxo-1H-1,2,4-triazol-4-yl]isoindole-1,3-dione Traditional Name: 2-[5-keto-3-(4-methylbenzyl)-1H-1,2,4-triazol-4-yl]isoindoline-1,3-quinone Formula: C18H14N4O3 MolecularWeight: 334.32876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NNC(=O)N2N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NNC(=O)N2N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H14N4O3/c1-11-6-8-12(9-7-11)10-15-19-20-18(25)21(15)22-16(23)13-4-2-3-5-14(13)17(22)24/h2-9H,10H2,1H3,(H,20,25)