7-(4-chlorophenyl)sulfonyl-1-piperazin-1-yl-isoquinoline hydrochloride

Systemtic Name: 7-(4-chlorophenyl)sulfonyl-1-piperazin-1-yl-isoquinoline hydrochloride Openeye Name: 7-(4-chlorophenyl)sulfonyl-1-piperazin-1-yl-isoquinoline hydrochloride CAS Name: 7-(4-chlorophenyl)sulfonyl-1-(1-piperazinyl)isoquinoline hydrochloride IUPAC Name: 7-(4-chlorophenyl)sulfonyl-1-piperazin-1-ylisoquinoline hydrochloride Traditional Name: 7-(4-chlorophenyl)sulfonyl-1-piperazino-isoquinoline hydrochloride Formula: C19H19Cl2N3O2S MolecularWeight: 424.34406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC=CC3=C2C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)Cl.Cl

Isomeric SMILES

C1CN(CCN1)C2=NC=CC3=C2C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)Cl.Cl

InChI

InChI=1S/C19H18ClN3O2S.ClH/c20-15-2-5-16(6-3-15)26(24,25)17-4-1-14-7-8-22-19(18(14)13-17)23-11-9-21-10-12-23;/h1-8,13,21H,9-12H2;1H