N-hexyl-N-(2-oxidanylideneoctyl)isoquinoline-5-sulfonamide

Systemtic Name: N-hexyl-N-(2-oxidanylideneoctyl)isoquinoline-5-sulfonamide Openeye Name: N-hexyl-N-(2-oxooctyl)isoquinoline-5-sulfonamide CAS Name: N-hexyl-N-(2-oxooctyl)-5-isoquinolinesulfonamide IUPAC Name: N-hexyl-N-(2-oxooctyl)isoquinoline-5-sulfonamide Traditional Name: N-hexyl-N-(2-ketooctyl)isoquinoline-5-sulfonamide Formula: C23H34N2O3S MolecularWeight: 418.59266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CN(CCCCCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCCCCC(=O)CN(CCCCCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C23H34N2O3S/c1-3-5-7-9-13-21(26)19-25(17-10-8-6-4-2)29(27,28)23-14-11-12-20-18-24-16-15-22(20)23/h11-12,14-16,18H,3-10,13,17,19H2,1-2H3