2-[2-methyl-1,3-bis(oxidanylidene)-4H-isoquinolin-4-yl]hexanediamide

Systemtic Name: 2-[2-methyl-1,3-bis(oxidanylidene)-4H-isoquinolin-4-yl]hexanediamide Openeye Name: 2-(2-methyl-1,3-dioxo-4H-isoquinolin-4-yl)hexanediamide CAS Name: 2-(2-methyl-1,3-dioxo-4H-isoquinolin-4-yl)hexanediamide IUPAC Name: 2-(2-methyl-1,3-dioxo-4H-isoquinolin-4-yl)hexanediamide Traditional Name: 2-(1,3-diketo-2-methyl-4H-isoquinolin-4-yl)adipamide Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C2=CC=CC=C2C1=O)C(CCCC(=O)N)C(=O)N

Isomeric SMILES

CN1C(=O)C(C2=CC=CC=C2C1=O)C(CCCC(=O)N)C(=O)N

InChI

InChI=1S/C16H19N3O4/c1-19-15(22)10-6-3-2-5-9(10)13(16(19)23)11(14(18)21)7-4-8-12(17)20/h2-3,5-6,11,13H,4,7-8H2,1H3,(H2,17,20)(H2,18,21)