N-(2-azanylethyl)-5-chloranyl-isoquinoline-8-sulfonamide dihydrochloride

Systemtic Name: N-(2-azanylethyl)-5-chloranyl-isoquinoline-8-sulfonamide dihydrochloride Openeye Name: N-(2-aminoethyl)-5-chloro-isoquinoline-8-sulfonamide dihydrochloride CAS Name: N-(2-aminoethyl)-5-chloro-8-isoquinolinesulfonamide dihydrochloride IUPAC Name: N-(2-aminoethyl)-5-chloroisoquinoline-8-sulfonamide dihydrochloride Traditional Name: N-(2-aminoethyl)-5-chloro-isoquinoline-8-sulfonamide dihydrochloride Formula: C11H14Cl3N3O2S MolecularWeight: 358.67176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=CN=CC2=C1S(=O)(=O)NCCN)Cl.Cl.Cl

Isomeric SMILES

C1=CC(=C2C=CN=CC2=C1S(=O)(=O)NCCN)Cl.Cl.Cl

InChI

InChI=1S/C11H12ClN3O2S.2ClH/c12-10-1-2-11(18(16,17)15-6-4-13)9-7-14-5-3-8(9)10;;/h1-3,5,7,15H,4,6,13H2;2*1H