4-hexyl-2-[(4-methoxyphenyl)methyl]isoindole-1,3-dione

Systemtic Name: 4-hexyl-2-[(4-methoxyphenyl)methyl]isoindole-1,3-dione Openeye Name: 4-hexyl-2-[(4-methoxyphenyl)methyl]isoindoline-1,3-dione CAS Name: 4-hexyl-2-[(4-methoxyphenyl)methyl]isoindole-1,3-dione IUPAC Name: 4-hexyl-2-[(4-methoxyphenyl)methyl]isoindole-1,3-dione Traditional Name: 4-hexyl-2-p-anisyl-isoindoline-1,3-quinone Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=CC2=C1C(=O)N(C2=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCC1=CC=CC2=C1C(=O)N(C2=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25NO3/c1-3-4-5-6-8-17-9-7-10-19-20(17)22(25)23(21(19)24)15-16-11-13-18(26-2)14-12-16/h7,9-14H,3-6,8,15H2,1-2H3