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N5-ethyl-N5-[2-(hexylamino)ethyl]isoquinoline-1,5-disulfonamide

N5-ethyl-N5-[2-(hexylamino)ethyl]isoquinoline-1,5-disulfonamide

Systemtic Name:N5-ethyl-N5-[2-(hexylamino)ethyl]isoquinoline-1,5-disulfonamide
Openeye Name:N5-ethyl-N5-[2-(hexylamino)ethyl]isoquinoline-1,5-disulfonamide
CAS Name:N5-ethyl-N5-[2-(hexylamino)ethyl]isoquinoline-1,5-disulfonamide
IUPAC Name:5-N-ethyl-5-N-[2-(hexylamino)ethyl]isoquinoline-1,5-disulfonamide
Traditional Name:N'-ethyl-N'-[2-(hexylamino)ethyl]isoquinoline-1,5-disulfonamide
Formula: C19H30N4O4S2
MolecularWeight: 442.5959
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCCN(CC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2S(=O)(=O)N


Isomeric SMILES

CCCCCCNCCN(CC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2S(=O)(=O)N


InChI

InChI=1S/C19H30N4O4S2/c1-3-5-6-7-12-21-14-15-23(4-2)29(26,27)18-10-8-9-17-16(18)11-13-22-19(17)28(20,24)25/h8-11,13,21H,3-7,12,14-15H2,1-2H3,(H2,20,24,25)


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