4-[(isoquinolin-5-ylamino)methylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[(isoquinolin-5-ylamino)methylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[(5-isoquinolylamino)methylene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[(5-isoquinolinylamino)methylidene]-2,6-dimethoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(isoquinolin-5-ylamino)methylidene]-2,6-dimethoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[(5-isoquinolylamino)methylene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNC2=CC=CC3=C2C=CN=C3)C=C(C1=O)OC

Isomeric SMILES

COC1=CC(=CNC2=CC=CC3=C2C=CN=C3)C=C(C1=O)OC

InChI

InChI=1S/C18H16N2O3/c1-22-16-8-12(9-17(23-2)18(16)21)10-20-15-5-3-4-13-11-19-7-6-14(13)15/h3-11,20H,1-2H3