N-hexyl-N-(3-oxidanylpropyl)isoquinoline-5-sulfonamide

Systemtic Name: N-hexyl-N-(3-oxidanylpropyl)isoquinoline-5-sulfonamide Openeye Name: N-hexyl-N-(3-hydroxypropyl)isoquinoline-5-sulfonamide CAS Name: N-hexyl-N-(3-hydroxypropyl)-5-isoquinolinesulfonamide IUPAC Name: N-hexyl-N-(3-hydroxypropyl)isoquinoline-5-sulfonamide Traditional Name: N-hexyl-N-(3-hydroxypropyl)isoquinoline-5-sulfonamide Formula: C18H26N2O3S MolecularWeight: 350.47564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCO)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCCCCN(CCCO)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C18H26N2O3S/c1-2-3-4-5-12-20(13-7-14-21)24(22,23)18-9-6-8-16-15-19-11-10-17(16)18/h6,8-11,15,21H,2-5,7,12-14H2,1H3