4-[[3-(diethylamino)propylamino]methylidene]-2-(2-ethoxyphenyl)isoquinoline-1,3-dione

Systemtic Name: 4-[[3-(diethylamino)propylamino]methylidene]-2-(2-ethoxyphenyl)isoquinoline-1,3-dione Openeye Name: 4-[[3-(diethylamino)propylamino]methylene]-2-(2-ethoxyphenyl)isoquinoline-1,3-dione CAS Name: 4-[[3-(diethylamino)propylamino]methylidene]-2-(2-ethoxyphenyl)isoquinoline-1,3-dione IUPAC Name: 4-[[3-(diethylamino)propylamino]methylidene]-2-(2-ethoxyphenyl)isoquinoline-1,3-dione Traditional Name: 4-[[3-(diethylamino)propylamino]methylene]-2-o-phenetyl-isoquinoline-1,3-quinone Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=C3OCC

Isomeric SMILES

CCN(CC)CCCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=C3OCC

InChI

InChI=1S/C25H31N3O3/c1-4-27(5-2)17-11-16-26-18-21-19-12-7-8-13-20(19)24(29)28(25(21)30)22-14-9-10-15-23(22)31-6-3/h7-10,12-15,18,26H,4-6,11,16-17H2,1-3H3