tert-butyl 2-methyl-2-[[(2-nitrophenoxy)-phenyl-phosphoryl]oxymethyl]-3-oxidanylidene-butanoate

Systemtic Name: tert-butyl 2-methyl-2-[[(2-nitrophenoxy)-phenyl-phosphoryl]oxymethyl]-3-oxidanylidene-butanoate Openeye Name: tert-butyl 2-methyl-2-[[(2-nitrophenoxy)-phenyl-phosphoryl]oxymethyl]-3-oxo-butanoate CAS Name: 2-methyl-2-[[(2-nitrophenoxy)-phenylphosphoryl]oxymethyl]-3-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-methyl-2-[[(2-nitrophenoxy)-phenylphosphoryl]oxymethyl]-3-oxobutanoate Traditional Name: 3-keto-2-methyl-2-[[(2-nitrophenoxy)-phenyl-phosphoryl]oxymethyl]butyric acid tert-butyl ester Formula: C22H26NO8P MolecularWeight: 463.417501

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(COP(=O)(C1=CC=CC=C1)OC2=CC=CC=C2[N+](=O)[O-])C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C(C)(COP(=O)(C1=CC=CC=C1)OC2=CC=CC=C2[N+](=O)[O-])C(=O)OC(C)(C)C

InChI

InChI=1S/C22H26NO8P/c1-16(24)22(5,20(25)30-21(2,3)4)15-29-32(28,17-11-7-6-8-12-17)31-19-14-10-9-13-18(19)23(26)27/h6-14H,15H2,1-5H3