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

Systemtic Name: N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[5-(3-methoxyphenyl)-8-isoquinolyl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[5-(3-methoxyphenyl)-8-isoquinolinyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[5-(3-methoxyphenyl)-8-isoquinolyl]methyl]-piperonylamide Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H20N2O4/c1-29-19-4-2-3-16(11-19)20-7-5-18(22-14-26-10-9-21(20)22)13-27-25(28)17-6-8-23-24(12-17)31-15-30-23/h2-12,14H,13,15H2,1H3,(H,27,28)