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N5-[2-(ethylamino)propyl]-N5-hexyl-isoquinoline-1,5-disulfonamide

N5-[2-(ethylamino)propyl]-N5-hexyl-isoquinoline-1,5-disulfonamide

Systemtic Name:N5-[2-(ethylamino)propyl]-N5-hexyl-isoquinoline-1,5-disulfonamide
Openeye Name:N5-[2-(ethylamino)propyl]-N5-hexyl-isoquinoline-1,5-disulfonamide
CAS Name:N5-[2-(ethylamino)propyl]-N5-hexylisoquinoline-1,5-disulfonamide
IUPAC Name:5-N-[2-(ethylamino)propyl]-5-N-hexylisoquinoline-1,5-disulfonamide
Traditional Name:N'-[2-(ethylamino)propyl]-N'-hexyl-isoquinoline-1,5-disulfonamide
Formula: C20H32N4O4S2
MolecularWeight: 456.62248
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CC(C)NCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2S(=O)(=O)N


Isomeric SMILES

CCCCCCN(CC(C)NCC)S(=O)(=O)C1=CC=CC2=C1C=CN=C2S(=O)(=O)N


InChI

InChI=1S/C20H32N4O4S2/c1-4-6-7-8-14-24(15-16(3)22-5-2)30(27,28)19-11-9-10-18-17(19)12-13-23-20(18)29(21,25)26/h9-13,16,22H,4-8,14-15H2,1-3H3,(H2,21,25,26)


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