7a-methyl-2-(4-oxidanylbutyl)-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione

Systemtic Name: 7a-methyl-2-(4-oxidanylbutyl)-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione Openeye Name: 2-(4-hydroxybutyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione CAS Name: 2-(4-hydroxybutyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione IUPAC Name: 2-(4-hydroxybutyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione Traditional Name: 2-(4-hydroxybutyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-quinone Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

CC12C(C=CC(C1C(=O)N(C2=O)CCCCO)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC12C(C=CC(C1C(=O)N(C2=O)CCCCO)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27NO3/c1-25-21(19-12-6-3-7-13-19)15-14-20(18-10-4-2-5-11-18)22(25)23(28)26(24(25)29)16-8-9-17-27/h2-7,10-15,20-22,27H,8-9,16-17H2,1H3