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

Systemtic Name: 2-[[4-cyano-2-(2-nitrophenyl)-1,3-oxazol-5-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-cyano-2-(2-nitrophenyl)oxazol-5-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[4-cyano-2-(2-nitrophenyl)-5-oxazolyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-cyano-2-(2-nitrophenyl)-1,3-oxazol-5-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-cyano-2-(2-nitrophenyl)oxazol-5-yl]amino]ethyl-dimethyl-ammonium Formula: C14H16N5O3+ MolecularWeight: 302.30854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=C(N=C(O1)C2=CC=CC=C2[N+](=O)[O-])C#N

Isomeric SMILES

C[NH+](C)CCNC1=C(N=C(O1)C2=CC=CC=C2[N+](=O)[O-])C#N

InChI

InChI=1S/C14H15N5O3/c1-18(2)8-7-16-14-11(9-15)17-13(22-14)10-5-3-4-6-12(10)19(20)21/h3-6,16H,7-8H2,1-2H3/p+1