2-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[2-keto-2-(3-phenyl-2-pyrazolin-1-yl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CN3C(=O)C4CC=CCC4C3=O

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CN3C(=O)C4CC=CCC4C3=O

InChI

InChI=1S/C19H19N3O3/c23-17(22-11-10-16(20-22)13-6-2-1-3-7-13)12-21-18(24)14-8-4-5-9-15(14)19(21)25/h1-7,14-15H,8-12H2