2,2-bis(5-methyl-2-propan-2-yl-cyclohexyl)-1-phosphonato-ethanone

Systemtic Name: 2,2-bis(5-methyl-2-propan-2-yl-cyclohexyl)-1-phosphonato-ethanone Openeye Name: 2,2-bis(2-isopropyl-5-methyl-cyclohexyl)-1-phosphonato-ethanone CAS Name: 2,2-bis(5-methyl-2-propan-2-ylcyclohexyl)-1-phosphonatoethanone IUPAC Name: 2,2-bis(5-methyl-2-propan-2-ylcyclohexyl)-1-phosphonatoethanone Traditional Name: 2,2-bis(2-isopropyl-5-methyl-cyclohexyl)-1-phosphonato-ethanone Formula: C22H39O4P-2 MolecularWeight: 398.516421

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)C(C2CC(CCC2C(C)C)C)C(=O)P(=O)([O-])[O-])C(C)C

Isomeric SMILES

CC1CCC(C(C1)C(C2CC(CCC2C(C)C)C)C(=O)P(=O)([O-])[O-])C(C)C

InChI

InChI=1S/C22H41O4P/c1-13(2)17-9-7-15(5)11-19(17)21(22(23)27(24,25)26)20-12-16(6)8-10-18(20)14(3)4/h13-21H,7-12H2,1-6H3,(H2,24,25,26)/p-2