4-[[(1-ethylpyrrolidin-2-yl)methylamino]methylidene]-2-(2,4,6-trimethylphenyl)isoquinoline-1,3-dione

Systemtic Name: 4-[[(1-ethylpyrrolidin-2-yl)methylamino]methylidene]-2-(2,4,6-trimethylphenyl)isoquinoline-1,3-dione Openeye Name: 4-[[(1-ethylpyrrolidin-2-yl)methylamino]methylene]-2-(2,4,6-trimethylphenyl)isoquinoline-1,3-dione CAS Name: 4-[[(1-ethyl-2-pyrrolidinyl)methylamino]methylidene]-2-(2,4,6-trimethylphenyl)isoquinoline-1,3-dione IUPAC Name: 4-[[(1-ethylpyrrolidin-2-yl)methylamino]methylidene]-2-(2,4,6-trimethylphenyl)isoquinoline-1,3-dione Traditional Name: 4-[[(1-ethylpyrrolidin-2-yl)methylamino]methylene]-2-mesityl-isoquinoline-1,3-quinone Formula: C26H31N3O2 MolecularWeight: 417.54324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=C(C=C(C=C4C)C)C

Isomeric SMILES

CCN1CCCC1CNC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=C(C=C(C=C4C)C)C

InChI

InChI=1S/C26H31N3O2/c1-5-28-12-8-9-20(28)15-27-16-23-21-10-6-7-11-22(21)25(30)29(26(23)31)24-18(3)13-17(2)14-19(24)4/h6-7,10-11,13-14,16,20,27H,5,8-9,12,15H2,1-4H3