2-[[2-(1,3-benzodioxol-5-yloxymethyl)-4-cyano-1,3-oxazol-5-yl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-(1,3-benzodioxol-5-yloxymethyl)-4-cyano-1,3-oxazol-5-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(1,3-benzodioxol-5-yloxymethyl)-4-cyano-oxazol-5-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-(1,3-benzodioxol-5-yloxymethyl)-4-cyano-5-oxazolyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-(1,3-benzodioxol-5-yloxymethyl)-4-cyano-1,3-oxazol-5-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-(1,3-benzodioxol-5-yloxymethyl)-4-cyano-oxazol-5-yl]amino]ethyl-dimethyl-ammonium Formula: C16H19N4O4+ MolecularWeight: 331.34646

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=C(N=C(O1)COC2=CC3=C(C=C2)OCO3)C#N

Isomeric SMILES

C[NH+](C)CCNC1=C(N=C(O1)COC2=CC3=C(C=C2)OCO3)C#N

InChI

InChI=1S/C16H18N4O4/c1-20(2)6-5-18-16-12(8-17)19-15(24-16)9-21-11-3-4-13-14(7-11)23-10-22-13/h3-4,7,18H,5-6,9-10H2,1-2H3/p+1