2-octadecanoyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-octadecanoyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-octadecanoyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(1-oxooctadecyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-octadecanoyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-stearoyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C26H43NO3 MolecularWeight: 417.62452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)N1C(=O)C2CC=CCC2C1=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N1C(=O)C2CC=CCC2C1=O

InChI

InChI=1S/C26H43NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-24(28)27-25(29)22-19-17-18-20-23(22)26(27)30/h17-18,22-23H,2-16,19-21H2,1H3