4-[[2-methyl-1,3-bis(oxidanylidene)-4H-isoquinolin-2-ium-2-yl]methyl]cyclohexa-2,4-diene-1-carboxamide

Systemtic Name: 4-[[2-methyl-1,3-bis(oxidanylidene)-4H-isoquinolin-2-ium-2-yl]methyl]cyclohexa-2,4-diene-1-carboxamide Openeye Name: 4-[(2-methyl-1,3-dioxo-4H-isoquinolin-2-ium-2-yl)methyl]cyclohexa-2,4-diene-1-carboxamide CAS Name: 4-[(2-methyl-1,3-dioxo-4H-isoquinolin-2-ium-2-yl)methyl]-1-cyclohexa-2,4-dienecarboxamide IUPAC Name: 4-[(2-methyl-1,3-dioxo-4H-isoquinolin-2-ium-2-yl)methyl]cyclohexa-2,4-diene-1-carboxamide Traditional Name: 4-[(1,3-diketo-2-methyl-4H-isoquinolin-2-ium-2-yl)methyl]cyclohexa-2,4-diene-1-carboxamide Formula: C18H19N2O3+ MolecularWeight: 311.35506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=O)CC2=CC=CC=C2C1=O)CC3=CCC(C=C3)C(=O)N

Isomeric SMILES

C[N+]1(C(=O)CC2=CC=CC=C2C1=O)CC3=CCC(C=C3)C(=O)N

InChI

InChI=1S/C18H18N2O3/c1-20(11-12-6-8-13(9-7-12)17(19)22)16(21)10-14-4-2-3-5-15(14)18(20)23/h2-8,13H,9-11H2,1H3,(H-,19,22)/p+1