4-[5-(4-phosphonoheptan-4-yl)naphthalen-1-yl]heptan-4-ylphosphonic acid

Systemtic Name: 4-[5-(4-phosphonoheptan-4-yl)naphthalen-1-yl]heptan-4-ylphosphonic acid Openeye Name: [1-[5-(1-phosphono-1-propyl-butyl)-1-naphthyl]-1-propyl-butyl]phosphonic acid CAS Name: 4-[5-(4-phosphonoheptan-4-yl)-1-naphthalenyl]heptan-4-ylphosphonic acid IUPAC Name: 4-[5-(4-phosphonoheptan-4-yl)naphthalen-1-yl]heptan-4-ylphosphonic acid Traditional Name: [1-[5-(1-phosphono-1-propyl-butyl)-1-naphthyl]-1-propyl-butyl]phosphonic acid Formula: C24H38O6P2 MolecularWeight: 484.502442

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C1=CC=CC2=C1C=CC=C2C(CCC)(CCC)P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCC(CCC)(C1=CC=CC2=C1C=CC=C2C(CCC)(CCC)P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C24H38O6P2/c1-5-15-23(16-6-2,31(25,26)27)21-13-9-12-20-19(21)11-10-14-22(20)24(17-7-3,18-8-4)32(28,29)30/h9-14H,5-8,15-18H2,1-4H3,(H2,25,26,27)(H2,28,29,30)