N-[(E)-isoquinolin-3-ylmethylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[(E)-isoquinolin-3-ylmethylideneamino]pyridine-4-carboxamide Openeye Name: N-[(E)-3-isoquinolylmethyleneamino]pyridine-4-carboxamide CAS Name: N-[(E)-3-isoquinolinylmethylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[(E)-isoquinolin-3-ylmethylideneamino]pyridine-4-carboxamide Traditional Name: N-[(E)-3-isoquinolylmethyleneamino]isonicotinamide Formula: C16H12N4O MolecularWeight: 276.29268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)C=NNC(=O)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)/C=N/NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C16H12N4O/c21-16(12-5-7-17-8-6-12)20-19-11-15-9-13-3-1-2-4-14(13)10-18-15/h1-11H,(H,20,21)/b19-11+