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

Systemtic Name: 2-[[4-cyano-2-[(4-phenylphenoxy)methyl]-1,3-oxazol-5-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-cyano-2-[(4-phenylphenoxy)methyl]oxazol-5-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[4-cyano-2-[(4-phenylphenoxy)methyl]-5-oxazolyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-cyano-2-[(4-phenylphenoxy)methyl]-1,3-oxazol-5-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-cyano-2-[(4-phenylphenoxy)methyl]oxazol-5-yl]amino]ethyl-dimethyl-ammonium Formula: C21H23N4O2+ MolecularWeight: 363.43292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=C(N=C(O1)COC2=CC=C(C=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

C[NH+](C)CCNC1=C(N=C(O1)COC2=CC=C(C=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C21H22N4O2/c1-25(2)13-12-23-21-19(14-22)24-20(27-21)15-26-18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-11,23H,12-13,15H2,1-2H3/p+1