methyl-[(2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: methyl-[(2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: methyl-[(2-oxo-1,3-benzoxazol-3-yl)methyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: methyl-[(2-oxo-1,3-benzoxazol-3-yl)methyl]-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: methyl-[(2-oxo-1,3-benzoxazol-3-yl)methyl]-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: (2-keto-1,3-benzoxazol-3-yl)methyl-methyl-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C19H19N4O2+ MolecularWeight: 335.37976

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1)C2=CC=CC=C2)CN3C4=CC=CC=C4OC3=O

Isomeric SMILES

C[NH+](CC1=CN(N=C1)C2=CC=CC=C2)CN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C19H18N4O2/c1-21(14-22-17-9-5-6-10-18(17)25-19(22)24)12-15-11-20-23(13-15)16-7-3-2-4-8-16/h2-11,13H,12,14H2,1H3/p+1