(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-[(2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]azanium

Systemtic Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-[(2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]azanium Openeye Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-[(2-oxo-1,3-benzoxazol-3-yl)methyl]ammonium CAS Name: (3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methyl-[(2-oxo-1,3-benzoxazol-3-yl)methyl]ammonium IUPAC Name: (3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methyl-[(2-oxo-1,3-benzoxazol-3-yl)methyl]azanium Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[(2-keto-1,3-benzoxazol-3-yl)methyl]-methyl-ammonium Formula: C21H23N4O2+ MolecularWeight: 363.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C[NH+](C)CN3C4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C[NH+](C)CN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H22N4O2/c1-15-18(16(2)25(22-15)17-9-5-4-6-10-17)13-23(3)14-24-19-11-7-8-12-20(19)27-21(24)26/h4-12H,13-14H2,1-3H3/p+1