2-(4-azanylbutyl)-4,5,6,7-tetraphenyl-isoindole-1,3-dione

Systemtic Name: 2-(4-azanylbutyl)-4,5,6,7-tetraphenyl-isoindole-1,3-dione Openeye Name: 2-(4-aminobutyl)-4,5,6,7-tetraphenyl-isoindoline-1,3-dione CAS Name: 2-(4-aminobutyl)-4,5,6,7-tetraphenylisoindole-1,3-dione IUPAC Name: 2-(4-aminobutyl)-4,5,6,7-tetraphenylisoindole-1,3-dione Traditional Name: 2-(4-aminobutyl)-4,5,6,7-tetraphenyl-isoindoline-1,3-quinone Formula: C36H30N2O2 MolecularWeight: 522.6356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=C3C(=C2C4=CC=CC=C4)C(=O)N(C3=O)CCCCN)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=C3C(=C2C4=CC=CC=C4)C(=O)N(C3=O)CCCCN)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C36H30N2O2/c37-23-13-14-24-38-35(39)33-31(27-19-9-3-10-20-27)29(25-15-5-1-6-16-25)30(26-17-7-2-8-18-26)32(34(33)36(38)40)28-21-11-4-12-22-28/h1-12,15-22H,13-14,23-24,37H2