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

Systemtic Name: 4-[(4-ethylpiperazin-1-yl)methylidene]-2-(2,4,6-trimethylphenyl)isoquinoline-1,3-dione Openeye Name: 4-[(4-ethylpiperazin-1-yl)methylene]-2-(2,4,6-trimethylphenyl)isoquinoline-1,3-dione CAS Name: 4-[(4-ethyl-1-piperazinyl)methylidene]-2-(2,4,6-trimethylphenyl)isoquinoline-1,3-dione IUPAC Name: 4-[(4-ethylpiperazin-1-yl)methylidene]-2-(2,4,6-trimethylphenyl)isoquinoline-1,3-dione Traditional Name: 4-[(4-ethylpiperazino)methylene]-2-mesityl-isoquinoline-1,3-quinone Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=C(C=C(C=C4C)C)C

Isomeric SMILES

CCN1CCN(CC1)C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=C(C=C(C=C4C)C)C

InChI

InChI=1S/C25H29N3O2/c1-5-26-10-12-27(13-11-26)16-22-20-8-6-7-9-21(20)24(29)28(25(22)30)23-18(3)14-17(2)15-19(23)4/h6-9,14-16H,5,10-13H2,1-4H3