methoxy-[3-methyl-1-phenyl-5-(phenylcarbonylimino)pyrazol-1-ium-4-yl]phosphinous acid

Systemtic Name: methoxy-[3-methyl-1-phenyl-5-(phenylcarbonylimino)pyrazol-1-ium-4-yl]phosphinous acid Openeye Name: (5-benzoylimino-3-methyl-1-phenyl-pyrazol-1-ium-4-yl)-methoxy-phosphinous acid CAS Name: (5-benzoylimino-3-methyl-1-phenyl-4-pyrazol-1-iumyl)-methoxyphosphinous acid IUPAC Name: (5-benzoylimino-3-methyl-1-phenylpyrazol-1-ium-4-yl)-methoxyphosphinous acid Traditional Name: (5-benzoylimino-3-methyl-1-phenyl-pyrazol-1-ium-4-yl)-methoxy-phosphinous acid Formula: C18H17N3O3P+ MolecularWeight: 354.319641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)C2=CC=CC=C2)[N+](=N1)C3=CC=CC=C3)P(O)OC

Isomeric SMILES

CC1=C(C(=NC(=O)C2=CC=CC=C2)[N+](=N1)C3=CC=CC=C3)P(O)OC

InChI

InChI=1S/C18H17N3O3P/c1-13-16(25(23)24-2)17(19-18(22)14-9-5-3-6-10-14)21(20-13)15-11-7-4-8-12-15/h3-12,23H,1-2H3/q+1