N-[[5-(4-methoxy-3-methyl-phenyl)isoquinolin-8-yl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[5-(4-methoxy-3-methyl-phenyl)isoquinolin-8-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[5-(4-methoxy-3-methyl-phenyl)-8-isoquinolyl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[5-(4-methoxy-3-methylphenyl)-8-isoquinolinyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[5-(4-methoxy-3-methylphenyl)isoquinolin-8-yl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[5-(4-methoxy-3-methyl-phenyl)-8-isoquinolyl]methyl]-piperonylamide Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)C4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)C4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C26H22N2O4/c1-16-11-17(4-7-23(16)30-2)20-6-3-19(22-14-27-10-9-21(20)22)13-28-26(29)18-5-8-24-25(12-18)32-15-31-24/h3-12,14H,13,15H2,1-2H3,(H,28,29)