[(4S)-4-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethylsulfonylamino]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[2-(1,3-benzodioxol-5-ylcarbonylamino)ethylsulfonylamino]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[2-(1,3-benzodioxole-5-carbonylamino)ethylsulfonylamino]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]ethylsulfonylamino]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[2-(1,3-benzodioxole-5-carbonylamino)ethylsulfonylamino]pentyl]-diethylazanium Traditional Name: diethyl-[(4S)-4-[2-(piperonyloylamino)ethylsulfonylamino]pentyl]ammonium Formula: C19H32N3O5S+ MolecularWeight: 414.53948

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NS(=O)(=O)CCNC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NS(=O)(=O)CCNC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C19H31N3O5S/c1-4-22(5-2)11-6-7-15(3)21-28(24,25)12-10-20-19(23)16-8-9-17-18(13-16)27-14-26-17/h8-9,13,15,21H,4-7,10-12,14H2,1-3H3,(H,20,23)/p+1/t15-/m0/s1