(3aR,7aS)-5-(2-methoxyphenyl)-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: (3aR,7aS)-5-(2-methoxyphenyl)-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aR,7aS)-5-(2-methoxyphenyl)-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aR,7aS)-5-(2-methoxyphenyl)-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aR,7aS)-5-(2-methoxyphenyl)-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aR,7aS)-5-(2-methoxyphenyl)-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CCC3C(C2)C(=O)N(C3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2=CC[C@H]3[C@@H](C2)C(=O)N(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H19NO3/c1-25-19-10-6-5-9-16(19)14-11-12-17-18(13-14)21(24)22(20(17)23)15-7-3-2-4-8-15/h2-11,17-18H,12-13H2,1H3/t17-,18+/m0/s1