4-[(1,3-benzodioxol-5-ylamino)methylidene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione

Systemtic Name: 4-[(1,3-benzodioxol-5-ylamino)methylidene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione Openeye Name: 4-[(1,3-benzodioxol-5-ylamino)methylene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione CAS Name: 4-[(1,3-benzodioxol-5-ylamino)methylidene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione IUPAC Name: 4-[(1,3-benzodioxol-5-ylamino)methylidene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione Traditional Name: 4-[(1,3-benzodioxol-5-ylamino)methylene]-2-p-anisyl-isoquinoline-1,3-quinone Formula: C25H20N2O5 MolecularWeight: 428.4367

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=CNC4=CC5=C(C=C4)OCO5)C2=O

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=CNC4=CC5=C(C=C4)OCO5)C2=O

InChI

InChI=1S/C25H20N2O5/c1-30-18-9-6-16(7-10-18)14-27-24(28)20-5-3-2-4-19(20)21(25(27)29)13-26-17-8-11-22-23(12-17)32-15-31-22/h2-13,26H,14-15H2,1H3