N-hexyl-1-(2-oxidanylidenepropyl)isoquinoline-5-sulfonamide

Systemtic Name: N-hexyl-1-(2-oxidanylidenepropyl)isoquinoline-5-sulfonamide Openeye Name: 1-acetonyl-N-hexyl-isoquinoline-5-sulfonamide CAS Name: N-hexyl-1-(2-oxopropyl)-5-isoquinolinesulfonamide IUPAC Name: N-hexyl-1-(2-oxopropyl)isoquinoline-5-sulfonamide Traditional Name: 1-acetonyl-N-hexyl-isoquinoline-5-sulfonamide Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2CC(=O)C

Isomeric SMILES

CCCCCCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2CC(=O)C

InChI

InChI=1S/C18H24N2O3S/c1-3-4-5-6-11-20-24(22,23)18-9-7-8-15-16(18)10-12-19-17(15)13-14(2)21/h7-10,12,20H,3-6,11,13H2,1-2H3