1-[3-di(propan-2-yloxy)phosphoryl-5-methyl-1-(4-nitrophenyl)pyrazol-4-yl]ethanone

Systemtic Name: 1-[3-di(propan-2-yloxy)phosphoryl-5-methyl-1-(4-nitrophenyl)pyrazol-4-yl]ethanone Openeye Name: 1-[3-diisopropoxyphosphoryl-5-methyl-1-(4-nitrophenyl)pyrazol-4-yl]ethanone CAS Name: 1-[3-di(propan-2-yloxy)phosphoryl-5-methyl-1-(4-nitrophenyl)-4-pyrazolyl]ethanone IUPAC Name: 1-[3-di(propan-2-yloxy)phosphoryl-5-methyl-1-(4-nitrophenyl)pyrazol-4-yl]ethanone Traditional Name: 1-[3-diisopropoxyphosphoryl-5-methyl-1-(4-nitrophenyl)pyrazol-4-yl]ethanone Formula: C18H24N3O6P MolecularWeight: 409.373421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])P(=O)(OC(C)C)OC(C)C)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])P(=O)(OC(C)C)OC(C)C)C(=O)C

InChI

InChI=1S/C18H24N3O6P/c1-11(2)26-28(25,27-12(3)4)18-17(14(6)22)13(5)20(19-18)15-7-9-16(10-8-15)21(23)24/h7-12H,1-6H3