3-oxidanylidene-N,2-bis(pyridin-3-ylmethyl)-1H-isoindole-4-carboxamide

Systemtic Name: 3-oxidanylidene-N,2-bis(pyridin-3-ylmethyl)-1H-isoindole-4-carboxamide Openeye Name: 3-oxo-N,2-bis(3-pyridylmethyl)isoindoline-4-carboxamide CAS Name: 3-oxo-N,2-bis(3-pyridinylmethyl)-1H-isoindole-4-carboxamide IUPAC Name: 3-oxo-N,2-bis(pyridin-3-ylmethyl)-1H-isoindole-4-carboxamide Traditional Name: 3-keto-N,2-bis(3-pyridylmethyl)isoindoline-4-carboxamide Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC(=C2C(=O)N1CC3=CN=CC=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1C2=CC=CC(=C2C(=O)N1CC3=CN=CC=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H18N4O2/c26-20(24-12-15-4-2-8-22-10-15)18-7-1-6-17-14-25(21(27)19(17)18)13-16-5-3-9-23-11-16/h1-11H,12-14H2,(H,24,26)