methyl-[2-oxidanylidene-2-[(2-phenoxyphenyl)amino]ethyl]-[(1-phenylpyrazol-4-yl)methyl]azanium

Systemtic Name: methyl-[2-oxidanylidene-2-[(2-phenoxyphenyl)amino]ethyl]-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: methyl-[2-oxo-2-(2-phenoxyanilino)ethyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: methyl-[2-oxo-2-(2-phenoxyanilino)ethyl]-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: methyl-[2-oxo-2-(2-phenoxyanilino)ethyl]-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: [2-keto-2-(2-phenoxyanilino)ethyl]-methyl-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C25H25N4O2+ MolecularWeight: 413.4916

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1)C2=CC=CC=C2)CC(=O)NC3=CC=CC=C3OC4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=CN(N=C1)C2=CC=CC=C2)CC(=O)NC3=CC=CC=C3OC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2/c1-28(17-20-16-26-29(18-20)21-10-4-2-5-11-21)19-25(30)27-23-14-8-9-15-24(23)31-22-12-6-3-7-13-22/h2-16,18H,17,19H2,1H3,(H,27,30)/p+1