3-oxidanylidenebutan-2-yl 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-oxidanylidene-2-phosphanyl-propanoate

Systemtic Name: 3-oxidanylidenebutan-2-yl 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-oxidanylidene-2-phosphanyl-propanoate Openeye Name: (1-methyl-2-oxo-propyl) 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-oxo-2-phosphanyl-propanoate CAS Name: 2-cyclohexyl-3-(2,6-dimethoxyphenyl)-3-oxo-2-phosphinopropanoic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-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-methyl-propyl) ester Formula: C21H29O6P MolecularWeight: 408.425121

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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