(3aR,4R,7aS)-6-methyl-4-phenethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: (3aR,4R,7aS)-6-methyl-4-phenethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aR,4R,7aS)-6-methyl-4-phenethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aR,4R,7aS)-6-methyl-4-phenethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aR,4R,7aS)-6-methyl-4-phenethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aR,4R,7aS)-6-methyl-4-phenethyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C17H19NO2 MolecularWeight: 269.33826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C2C(C1)C(=O)NC2=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C[C@H]([C@@H]2[C@H](C1)C(=O)NC2=O)CCC3=CC=CC=C3

InChI

InChI=1S/C17H19NO2/c1-11-9-13(8-7-12-5-3-2-4-6-12)15-14(10-11)16(19)18-17(15)20/h2-6,9,13-15H,7-8,10H2,1H3,(H,18,19,20)/t13-,14+,15-/m1/s1