2-[7-methoxy-2-methyl-1,3-bis(oxidanylidene)-4H-isoquinolin-4-yl]hexanediamide

Systemtic Name: 2-[7-methoxy-2-methyl-1,3-bis(oxidanylidene)-4H-isoquinolin-4-yl]hexanediamide Openeye Name: 2-(7-methoxy-2-methyl-1,3-dioxo-4H-isoquinolin-4-yl)hexanediamide CAS Name: 2-(7-methoxy-2-methyl-1,3-dioxo-4H-isoquinolin-4-yl)hexanediamide IUPAC Name: 2-(7-methoxy-2-methyl-1,3-dioxo-4H-isoquinolin-4-yl)hexanediamide Traditional Name: 2-(1,3-diketo-7-methoxy-2-methyl-4H-isoquinolin-4-yl)adipamide Formula: C17H21N3O5 MolecularWeight: 347.36574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C2=C(C1=O)C=C(C=C2)OC)C(CCCC(=O)N)C(=O)N

Isomeric SMILES

CN1C(=O)C(C2=C(C1=O)C=C(C=C2)OC)C(CCCC(=O)N)C(=O)N

InChI

InChI=1S/C17H21N3O5/c1-20-16(23)12-8-9(25-2)6-7-10(12)14(17(20)24)11(15(19)22)4-3-5-13(18)21/h6-8,11,14H,3-5H2,1-2H3,(H2,18,21)(H2,19,22)