3-[[4-cyano-2-(phenoxymethyl)-1,3-oxazol-5-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-cyano-2-(phenoxymethyl)-1,3-oxazol-5-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[4-cyano-2-(phenoxymethyl)oxazol-5-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[4-cyano-2-(phenoxymethyl)-5-oxazolyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-cyano-2-(phenoxymethyl)-1,3-oxazol-5-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[4-cyano-2-(phenoxymethyl)oxazol-5-yl]amino]propyl-dimethyl-ammonium Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=C(N=C(O1)COC2=CC=CC=C2)C#N

Isomeric SMILES

C[NH+](C)CCCNC1=C(N=C(O1)COC2=CC=CC=C2)C#N

InChI

InChI=1S/C16H20N4O2/c1-20(2)10-6-9-18-16-14(11-17)19-15(22-16)12-21-13-7-4-3-5-8-13/h3-5,7-8,18H,6,9-10,12H2,1-2H3/p+1