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

Systemtic Name: N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]adamantane-1-carboxamide Openeye Name: N-[[5-(3-methoxyphenyl)-8-isoquinolyl]methyl]adamantane-1-carboxamide CAS Name: N-[[5-(3-methoxyphenyl)-8-isoquinolinyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]adamantane-1-carboxamide Traditional Name: N-[[5-(3-methoxyphenyl)-8-isoquinolyl]methyl]adamantane-1-carboxamide Formula: C28H30N2O2 MolecularWeight: 426.55

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H30N2O2/c1-32-23-4-2-3-21(12-23)24-6-5-22(26-17-29-8-7-25(24)26)16-30-27(31)28-13-18-9-19(14-28)11-20(10-18)15-28/h2-8,12,17-20H,9-11,13-16H2,1H3,(H,30,31)