4,5,6,7-tetrakis(chloranyl)-2-(3-octadecoxyphenyl)isoindole-1,3-dione

Systemtic Name: 4,5,6,7-tetrakis(chloranyl)-2-(3-octadecoxyphenyl)isoindole-1,3-dione Openeye Name: 4,5,6,7-tetrachloro-2-(3-octadecoxyphenyl)isoindoline-1,3-dione CAS Name: 4,5,6,7-tetrachloro-2-(3-octadecoxyphenyl)isoindole-1,3-dione IUPAC Name: 4,5,6,7-tetrachloro-2-(3-octadecoxyphenyl)isoindole-1,3-dione Traditional Name: 4,5,6,7-tetrachloro-2-(3-stearyloxyphenyl)isoindoline-1,3-quinone Formula: C32H41Cl4NO3 MolecularWeight: 629.48484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl

InChI

InChI=1S/C32H41Cl4NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-40-24-20-18-19-23(22-24)37-31(38)25-26(32(37)39)28(34)30(36)29(35)27(25)33/h18-20,22H,2-17,21H2,1H3