2-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[1,3-dioxo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[1,3-dioxo-2-(2-pyridinyl)-4-isoquinolinylidene]methylamino]ethyl-dimethylammonium IUPAC Name: 2-[(1,3-dioxo-2-pyridin-2-ylisoquinolin-4-ylidene)methylamino]ethyl-dimethylazanium Traditional Name: 2-[[1,3-diketo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]ethyl-dimethyl-ammonium Formula: C19H21N4O2+ MolecularWeight: 337.39564

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3

Isomeric SMILES

C[NH+](C)CCNC=C1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=N3

InChI

InChI=1S/C19H20N4O2/c1-22(2)12-11-20-13-16-14-7-3-4-8-15(14)18(24)23(19(16)25)17-9-5-6-10-21-17/h3-10,13,20H,11-12H2,1-2H3/p+1