(4Z)-4-[(7-methoxy-1,3-benzodioxol-5-yl)methylidene]-2-(3-methylphenyl)isoquinoline-1,3-dione

Systemtic Name: (4Z)-4-[(7-methoxy-1,3-benzodioxol-5-yl)methylidene]-2-(3-methylphenyl)isoquinoline-1,3-dione Openeye Name: (4Z)-4-[(7-methoxy-1,3-benzodioxol-5-yl)methylene]-2-(m-tolyl)isoquinoline-1,3-dione CAS Name: (4Z)-4-[(7-methoxy-1,3-benzodioxol-5-yl)methylidene]-2-(3-methylphenyl)isoquinoline-1,3-dione IUPAC Name: (4Z)-4-[(7-methoxy-1,3-benzodioxol-5-yl)methylidene]-2-(3-methylphenyl)isoquinoline-1,3-dione Traditional Name: (4Z)-4-[(7-methoxy-1,3-benzodioxol-5-yl)methylene]-2-(m-tolyl)isoquinoline-1,3-quinone Formula: C25H19NO5 MolecularWeight: 413.42206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC5=C(C(=C4)OC)OCO5)C2=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3/C(=C/C4=CC5=C(C(=C4)OC)OCO5)/C2=O

InChI

InChI=1S/C25H19NO5/c1-15-6-5-7-17(10-15)26-24(27)19-9-4-3-8-18(19)20(25(26)28)11-16-12-21(29-2)23-22(13-16)30-14-31-23/h3-13H,14H2,1-2H3/b20-11-