1-oxidanylidene-N-(pyridin-3-ylmethyl)-2H-isoquinoline-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-(pyridin-3-ylmethyl)-2H-isoquinoline-3-carboxamide Openeye Name: 1-oxo-N-(3-pyridylmethyl)-2H-isoquinoline-3-carboxamide CAS Name: 1-oxo-N-(3-pyridinylmethyl)-2H-isoquinoline-3-carboxamide IUPAC Name: 1-oxo-N-(pyridin-3-ylmethyl)-2H-isoquinoline-3-carboxamide Traditional Name: 1-keto-N-(3-pyridylmethyl)-2H-isoquinoline-3-carboxamide Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(NC2=O)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(NC2=O)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C16H13N3O2/c20-15-13-6-2-1-5-12(13)8-14(19-15)16(21)18-10-11-4-3-7-17-9-11/h1-9H,10H2,(H,18,21)(H,19,20)