(3aS,7aR)-2-(2-phenylazanylethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: (3aS,7aR)-2-(2-phenylazanylethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aS,7aR)-2-(2-anilinoethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aS,7aR)-2-(2-anilinoethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aS,7aR)-2-(2-anilinoethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aS,7aR)-2-(2-anilinoethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)CCNC3=CC=CC=C3

Isomeric SMILES

C1C=CC[C@H]2[C@@H]1C(=O)N(C2=O)CCNC3=CC=CC=C3

InChI

InChI=1S/C16H18N2O2/c19-15-13-8-4-5-9-14(13)16(20)18(15)11-10-17-12-6-2-1-3-7-12/h1-7,13-14,17H,8-11H2/t13-,14+