N-(1-azanylnonyl)-N-hexyl-isoquinoline-5-sulfonamide

Systemtic Name: N-(1-azanylnonyl)-N-hexyl-isoquinoline-5-sulfonamide Openeye Name: N-(1-aminononyl)-N-hexyl-isoquinoline-5-sulfonamide CAS Name: N-(1-aminononyl)-N-hexyl-5-isoquinolinesulfonamide IUPAC Name: N-(1-aminononyl)-N-hexylisoquinoline-5-sulfonamide Traditional Name: N-(1-aminononyl)-N-hexyl-isoquinoline-5-sulfonamide Formula: C24H39N3O2S MolecularWeight: 433.65036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H39N3O2S/c1-3-5-7-9-10-11-16-24(25)27(19-12-8-6-4-2)30(28,29)23-15-13-14-21-20-26-18-17-22(21)23/h13-15,17-18,20,24H,3-12,16,19,25H2,1-2H3