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N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]ethanamide

N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]ethanamide

Systemtic Name:N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]ethanamide
Openeye Name:N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]acetamide
CAS Name:N-[3-(1-azepanylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]acetamide
IUPAC Name:N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]acetamide
Traditional Name:N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[ethyl(piperonyl)amino]acetamide
Formula: C24H31N3O5S
MolecularWeight: 473.58504
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4


Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4


InChI

InChI=1S/C24H31N3O5S/c1-2-26(16-19-10-11-22-23(14-19)32-18-31-22)17-24(28)25-20-8-7-9-21(15-20)33(29,30)27-12-5-3-4-6-13-27/h7-11,14-15H,2-6,12-13,16-18H2,1H3,(H,25,28)


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