2-phenethyl-3a,4,5,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-phenethyl-3a,4,5,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-phenethyl-3a,4,5,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-phenethyl-3a,4,5,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-phenethyl-3a,4,5,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-phenethyl-3a,4,5,7a-tetrahydroisoindole-1,3-quinone Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C=C1)C(=O)N(C2=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CC2C(C=C1)C(=O)N(C2=O)CCC3=CC=CC=C3

InChI

InChI=1S/C16H17NO2/c18-15-13-8-4-5-9-14(13)16(19)17(15)11-10-12-6-2-1-3-7-12/h1-4,6-8,13-14H,5,9-11H2