2-[[(5-butyl-6-methyl-2-oxidanylidene-1H-pyridin-3-yl)amino]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[(5-butyl-6-methyl-2-oxidanylidene-1H-pyridin-3-yl)amino]methyl]isoindole-1,3-dione Openeye Name: 2-[[(5-butyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]methyl]isoindoline-1,3-dione CAS Name: 2-[[(5-butyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]methyl]isoindole-1,3-dione IUPAC Name: 2-[[(5-butyl-6-methyl-2-oxo-1H-pyridin-3-yl)amino]methyl]isoindole-1,3-dione Traditional Name: 2-[[(5-butyl-2-keto-6-methyl-1H-pyridin-3-yl)amino]methyl]isoindoline-1,3-quinone Formula: C19H21N3O3 MolecularWeight: 339.38834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=O)C(=C1)NCN2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CCCCC1=C(NC(=O)C(=C1)NCN2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C19H21N3O3/c1-3-4-7-13-10-16(17(23)21-12(13)2)20-11-22-18(24)14-8-5-6-9-15(14)19(22)25/h5-6,8-10,20H,3-4,7,11H2,1-2H3,(H,21,23)