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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C(=O)C(=C1)CN2C(=O)C3=CC=CC=C3C2=O)N)C

Isomeric SMILES

CCCCC1=C(N(C(=O)C(=C1)CN2C(=O)C3=CC=CC=C3C2=O)N)C

InChI

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