N-[2-(oxan-4-ylmethyl)-1-oxidanylidene-isoquinolin-5-yl]naphthalene-2-carboxamide

Systemtic Name: N-[2-(oxan-4-ylmethyl)-1-oxidanylidene-isoquinolin-5-yl]naphthalene-2-carboxamide Openeye Name: N-[1-oxo-2-(tetrahydropyran-4-ylmethyl)-5-isoquinolyl]naphthalene-2-carboxamide CAS Name: N-[2-(4-oxanylmethyl)-1-oxo-5-isoquinolinyl]-2-naphthalenecarboxamide IUPAC Name: N-[2-(oxan-4-ylmethyl)-1-oxoisoquinolin-5-yl]naphthalene-2-carboxamide Traditional Name: N-[1-keto-2-(tetrahydropyran-4-ylmethyl)-5-isoquinolyl]-2-naphthamide Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CN2C=CC3=C(C2=O)C=CC=C3NC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1COCCC1CN2C=CC3=C(C2=O)C=CC=C3NC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H24N2O3/c29-25(21-9-8-19-4-1-2-5-20(19)16-21)27-24-7-3-6-23-22(24)10-13-28(26(23)30)17-18-11-14-31-15-12-18/h1-10,13,16,18H,11-12,14-15,17H2,(H,27,29)