2-(pyridin-3-ylmethyl)-3-(pyridin-3-ylmethylamino)-3H-isoindol-1-one

Systemtic Name: 2-(pyridin-3-ylmethyl)-3-(pyridin-3-ylmethylamino)-3H-isoindol-1-one Openeye Name: 2-(3-pyridylmethyl)-3-(3-pyridylmethylamino)isoindolin-1-one CAS Name: 2-(3-pyridinylmethyl)-3-(3-pyridinylmethylamino)-3H-isoindol-1-one IUPAC Name: 2-(pyridin-3-ylmethyl)-3-(pyridin-3-ylmethylamino)-3H-isoindol-1-one Traditional Name: 2-(3-pyridylmethyl)-3-(3-pyridylmethylamino)isoindolin-1-one Formula: C20H18N4O MolecularWeight: 330.38312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(N(C2=O)CC3=CN=CC=C3)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(N(C2=O)CC3=CN=CC=C3)NCC4=CN=CC=C4

InChI

InChI=1S/C20H18N4O/c25-20-18-8-2-1-7-17(18)19(23-13-15-5-3-9-21-11-15)24(20)14-16-6-4-10-22-12-16/h1-12,19,23H,13-14H2