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

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

Systemtic Name:N-(1-azanyloctyl)-N-hexyl-isoquinoline-5-sulfonamide
Openeye Name:N-(1-aminooctyl)-N-hexyl-isoquinoline-5-sulfonamide
CAS Name:N-(1-aminooctyl)-N-hexyl-5-isoquinolinesulfonamide
IUPAC Name:N-(1-aminooctyl)-N-hexylisoquinoline-5-sulfonamide
Traditional Name:N-(1-aminooctyl)-N-hexyl-isoquinoline-5-sulfonamide
Formula: C23H37N3O2S
MolecularWeight: 419.62378
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C23H37N3O2S/c1-3-5-7-9-10-15-23(24)26(18-11-8-6-4-2)29(27,28)22-14-12-13-20-19-25-17-16-21(20)22/h12-14,16-17,19,23H,3-11,15,18,24H2,1-2H3


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