(2-methyl-1-oxidanylidene-propan-2-yl) 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-oxidanylidene-2-phosphanyl-propanoate

Systemtic Name: (2-methyl-1-oxidanylidene-propan-2-yl) 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-oxidanylidene-2-phosphanyl-propanoate Openeye Name: (1,1-dimethyl-2-oxo-ethyl) 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-oxo-2-phosphanyl-propanoate CAS Name: 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-oxo-2-phosphinopropanoic acid (2-methyl-1-oxopropan-2-yl) ester IUPAC Name: (2-methyl-1-oxopropan-2-yl) 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-oxo-2-phosphanylpropanoate Traditional Name: 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-keto-2-phosphino-propionic acid (2-keto-1,1-dimethyl-ethyl) ester Formula: C21H29O6P MolecularWeight: 408.425121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=O)OC(=O)C(C1CCCCC1)(C(=O)C2=C(C=CC=C2OC)OC)P

Isomeric SMILES

CC(C)(C=O)OC(=O)C(C1CCCCC1)(C(=O)C2=C(C=CC=C2OC)OC)P

InChI

InChI=1S/C21H29O6P/c1-20(2,13-22)27-19(24)21(28,14-9-6-5-7-10-14)18(23)17-15(25-3)11-8-12-16(17)26-4/h8,11-14H,5-7,9-10,28H2,1-4H3