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[4-[2-[6-(heptylamino)hexanoylamino]ethyl]phenyl] sulfamate

[4-[2-[6-(heptylamino)hexanoylamino]ethyl]phenyl] sulfamate

Systemtic Name:[4-[2-[6-(heptylamino)hexanoylamino]ethyl]phenyl] sulfamate
Openeye Name:[4-[2-[6-(heptylamino)hexanoylamino]ethyl]phenyl] sulfamate
CAS Name:sulfamic acid [4-[2-[[6-(heptylamino)-1-oxohexyl]amino]ethyl]phenyl] ester
IUPAC Name:[4-[2-[6-(heptylamino)hexanoylamino]ethyl]phenyl] sulfamate
Traditional Name:sulfamic acid [4-[2-[6-(heptylamino)hexanoylamino]ethyl]phenyl] ester
Formula: C21H37N3O4S
MolecularWeight: 427.60118
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCCCCCC(=O)NCCC1=CC=C(C=C1)OS(=O)(=O)N


Isomeric SMILES

CCCCCCCNCCCCCC(=O)NCCC1=CC=C(C=C1)OS(=O)(=O)N


InChI

InChI=1S/C21H37N3O4S/c1-2-3-4-5-8-16-23-17-9-6-7-10-21(25)24-18-15-19-11-13-20(14-12-19)28-29(22,26)27/h11-14,23H,2-10,15-18H2,1H3,(H,24,25)(H2,22,26,27)


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