8-chloranyl-5-piperazin-1-ylsulfonyl-isoquinoline dihydrochloride

Systemtic Name: 8-chloranyl-5-piperazin-1-ylsulfonyl-isoquinoline dihydrochloride Openeye Name: 8-chloro-5-piperazin-1-ylsulfonyl-isoquinoline dihydrochloride CAS Name: 8-chloro-5-(1-piperazinylsulfonyl)isoquinoline dihydrochloride IUPAC Name: 8-chloro-5-piperazin-1-ylsulfonylisoquinoline dihydrochloride Traditional Name: 8-chloro-5-piperazinosulfonyl-isoquinoline dihydrochloride Formula: C13H16Cl3N3O2S MolecularWeight: 384.70904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)S(=O)(=O)C2=C3C=CN=CC3=C(C=C2)Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1)S(=O)(=O)C2=C3C=CN=CC3=C(C=C2)Cl.Cl.Cl

InChI

InChI=1S/C13H14ClN3O2S.2ClH/c14-12-1-2-13(10-3-4-16-9-11(10)12)20(18,19)17-7-5-15-6-8-17;;/h1-4,9,15H,5-8H2;2*1H