dimethyl-[2-[2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanoylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanoylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[2-(3-methyl-1-oxo-2-isoquinolyl)acetyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[2-(3-methyl-1-oxo-2-isoquinolinyl)-1-oxoethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[2-(3-methyl-1-oxoisoquinolin-2-yl)acetyl]amino]ethyl]azanium Traditional Name: 2-[[2-(1-keto-3-methyl-2-isoquinolyl)acetyl]amino]ethyl-dimethyl-ammonium Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC[NH+](C)C

Isomeric SMILES

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC[NH+](C)C

InChI

InChI=1S/C16H21N3O2/c1-12-10-13-6-4-5-7-14(13)16(21)19(12)11-15(20)17-8-9-18(2)3/h4-7,10H,8-9,11H2,1-3H3,(H,17,20)/p+1