4,5-dimethoxy-2-(1H-pyrazol-5-ylmethyl)isoindole-1,3-dione

Systemtic Name: 4,5-dimethoxy-2-(1H-pyrazol-5-ylmethyl)isoindole-1,3-dione Openeye Name: 4,5-dimethoxy-2-(1H-pyrazol-5-ylmethyl)isoindoline-1,3-dione CAS Name: 4,5-dimethoxy-2-(1H-pyrazol-5-ylmethyl)isoindole-1,3-dione IUPAC Name: 4,5-dimethoxy-2-(1H-pyrazol-5-ylmethyl)isoindole-1,3-dione Traditional Name: 4,5-dimethoxy-2-(1H-pyrazol-5-ylmethyl)isoindoline-1,3-quinone Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=O)N(C2=O)CC3=CC=NN3)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=O)N(C2=O)CC3=CC=NN3)OC

InChI

InChI=1S/C14H13N3O4/c1-20-10-4-3-9-11(12(10)21-2)14(19)17(13(9)18)7-8-5-6-15-16-8/h3-6H,7H2,1-2H3,(H,15,16)