N-hexyl-N-(2-piperidin-1-ylpropyl)isoquinoline-5-sulfonamide

Systemtic Name: N-hexyl-N-(2-piperidin-1-ylpropyl)isoquinoline-5-sulfonamide Openeye Name: N-hexyl-N-[2-(1-piperidyl)propyl]isoquinoline-5-sulfonamide CAS Name: N-hexyl-N-[2-(1-piperidinyl)propyl]-5-isoquinolinesulfonamide IUPAC Name: N-hexyl-N-(2-piperidin-1-ylpropyl)isoquinoline-5-sulfonamide Traditional Name: N-hexyl-N-(2-piperidinopropyl)isoquinoline-5-sulfonamide Formula: C23H35N3O2S MolecularWeight: 417.6079

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CC(C)N1CCCCC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCCCCN(CC(C)N1CCCCC1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C23H35N3O2S/c1-3-4-5-9-17-26(19-20(2)25-15-7-6-8-16-25)29(27,28)23-12-10-11-21-18-24-14-13-22(21)23/h10-14,18,20H,3-9,15-17,19H2,1-2H3