5,6-bis[(3,5-dimethylphenyl)amino]-2-(4-methoxyphenyl)isoindole-1,3-dione

Systemtic Name: 5,6-bis[(3,5-dimethylphenyl)amino]-2-(4-methoxyphenyl)isoindole-1,3-dione Openeye Name: 5,6-bis(3,5-dimethylanilino)-2-(4-methoxyphenyl)isoindoline-1,3-dione CAS Name: 5,6-bis(3,5-dimethylanilino)-2-(4-methoxyphenyl)isoindole-1,3-dione IUPAC Name: 5,6-bis(3,5-dimethylanilino)-2-(4-methoxyphenyl)isoindole-1,3-dione Traditional Name: 5,6-bis(3,5-dimethylanilino)-2-(4-methoxyphenyl)isoindoline-1,3-quinone Formula: C31H29N3O3 MolecularWeight: 491.58026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C=C3C(=C2)C(=O)N(C3=O)C4=CC=C(C=C4)OC)NC5=CC(=CC(=C5)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C=C3C(=C2)C(=O)N(C3=O)C4=CC=C(C=C4)OC)NC5=CC(=CC(=C5)C)C)C

InChI

InChI=1S/C31H29N3O3/c1-18-10-19(2)13-22(12-18)32-28-16-26-27(17-29(28)33-23-14-20(3)11-21(4)15-23)31(36)34(30(26)35)24-6-8-25(37-5)9-7-24/h6-17,32-33H,1-5H3