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

Systemtic Name: 3-[[4-cyano-2-(4-nitrophenyl)-1,3-oxazol-5-yl]amino]propyl-diethyl-azanium Openeye Name: 3-[[4-cyano-2-(4-nitrophenyl)oxazol-5-yl]amino]propyl-diethyl-ammonium CAS Name: 3-[[4-cyano-2-(4-nitrophenyl)-5-oxazolyl]amino]propyl-diethylammonium IUPAC Name: 3-[[4-cyano-2-(4-nitrophenyl)-1,3-oxazol-5-yl]amino]propyl-diethylazanium Traditional Name: 3-[[4-cyano-2-(4-nitrophenyl)oxazol-5-yl]amino]propyl-diethyl-ammonium Formula: C17H22N5O3+ MolecularWeight: 344.38828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5O3/c1-3-21(4-2)11-5-10-19-17-15(12-18)20-16(25-17)13-6-8-14(9-7-13)22(23)24/h6-9,19H,3-5,10-11H2,1-2H3/p+1