[(4S)-4-[[(1,3-benzodioxol-5-ylcarbonylamino)-ethoxy-methylidene]amino]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[[(1,3-benzodioxol-5-ylcarbonylamino)-ethoxy-methylidene]amino]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[[(1,3-benzodioxole-5-carbonylamino)-ethoxy-methylene]amino]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[[[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-ethoxymethylidene]amino]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[[(1,3-benzodioxole-5-carbonylamino)-ethoxymethylidene]amino]pentyl]-diethylazanium Traditional Name: [(4S)-4-[[ethoxy-(piperonyloylamino)methylene]amino]pentyl]-diethyl-ammonium Formula: C20H32N3O4+ MolecularWeight: 378.48578

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)N=C(NC(=O)C1=CC2=C(C=C1)OCO2)OCC

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)N=C(NC(=O)C1=CC2=C(C=C1)OCO2)OCC

InChI

InChI=1S/C20H31N3O4/c1-5-23(6-2)12-8-9-15(4)21-20(25-7-3)22-19(24)16-10-11-17-18(13-16)27-14-26-17/h10-11,13,15H,5-9,12,14H2,1-4H3,(H,21,22,24)/p+1/t15-/m0/s1