[dicyclohexyl-[5-[dicyclohexyl(phosphono)methyl]naphthalen-1-yl]methyl]phosphonic acid

Systemtic Name: [dicyclohexyl-[5-[dicyclohexyl(phosphono)methyl]naphthalen-1-yl]methyl]phosphonic acid Openeye Name: [dicyclohexyl-[5-[dicyclohexyl(phosphono)methyl]-1-naphthyl]methyl]phosphonic acid CAS Name: [dicyclohexyl-[5-[dicyclohexyl(phosphono)methyl]-1-naphthalenyl]methyl]phosphonic acid IUPAC Name: [dicyclohexyl-[5-[dicyclohexyl(phosphono)methyl]naphthalen-1-yl]methyl]phosphonic acid Traditional Name: [dicyclohexyl-[5-[dicyclohexyl(phosphono)methyl]-1-naphthyl]methyl]phosphonic acid Formula: C36H54O6P2 MolecularWeight: 644.757882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2CCCCC2)(C3=CC=CC4=C3C=CC=C4C(C5CCCCC5)(C6CCCCC6)P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1CCC(CC1)C(C2CCCCC2)(C3=CC=CC4=C3C=CC=C4C(C5CCCCC5)(C6CCCCC6)P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C36H54O6P2/c37-43(38,39)35(27-15-5-1-6-16-27,28-17-7-2-8-18-28)33-25-13-24-32-31(33)23-14-26-34(32)36(44(40,41)42,29-19-9-3-10-20-29)30-21-11-4-12-22-30/h13-14,23-30H,1-12,15-22H2,(H2,37,38,39)(H2,40,41,42)