2-(isoquinolin-5-ylsulfonylamino)ethyl-methyl-azanium

Systemtic Name: 2-(isoquinolin-5-ylsulfonylamino)ethyl-methyl-azanium Openeye Name: 2-(5-isoquinolylsulfonylamino)ethyl-methyl-ammonium CAS Name: 2-(5-isoquinolinylsulfonylamino)ethyl-methylammonium IUPAC Name: 2-(isoquinolin-5-ylsulfonylamino)ethyl-methylazanium Traditional Name: 2-(5-isoquinolylsulfonylamino)ethyl-methyl-ammonium Formula: C12H16N3O2S+ MolecularWeight: 266.33934

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

C[NH2+]CCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C12H15N3O2S/c1-13-7-8-15-18(16,17)12-4-2-3-10-9-14-6-5-11(10)12/h2-6,9,13,15H,7-8H2,1H3/p+1