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

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl-methyl-[(2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]azanium Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl-methyl-[(2-oxo-1,3-benzoxazol-3-yl)methyl]ammonium CAS Name: (1,3-diphenyl-4-pyrazolyl)methyl-methyl-[(2-oxo-1,3-benzoxazol-3-yl)methyl]ammonium IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl-methyl-[(2-oxo-1,3-benzoxazol-3-yl)methyl]azanium Traditional Name: (1,3-diphenylpyrazol-4-yl)methyl-[(2-keto-1,3-benzoxazol-3-yl)methyl]-methyl-ammonium Formula: C25H23N4O2+ MolecularWeight: 411.47572

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CN4C5=CC=CC=C5OC4=O

Isomeric SMILES

C[NH+](CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CN4C5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H22N4O2/c1-27(18-28-22-14-8-9-15-23(22)31-25(28)30)16-20-17-29(21-12-6-3-7-13-21)26-24(20)19-10-4-2-5-11-19/h2-15,17H,16,18H2,1H3/p+1