[1-phosphono-4-[4-(4-propylphenyl)phenyl]butyl]phosphonic acid

Systemtic Name: [1-phosphono-4-[4-(4-propylphenyl)phenyl]butyl]phosphonic acid Openeye Name: [1-phosphono-4-[4-(4-propylphenyl)phenyl]butyl]phosphonic acid CAS Name: [1-phosphono-4-[4-(4-propylphenyl)phenyl]butyl]phosphonic acid IUPAC Name: [1-phosphono-4-[4-(4-propylphenyl)phenyl]butyl]phosphonic acid Traditional Name: [1-phosphono-4-[4-(4-propylphenyl)phenyl]butyl]phosphonic acid Formula: C19H26O6P2 MolecularWeight: 412.353662

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)CCCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)CCCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C19H26O6P2/c1-2-4-15-7-11-17(12-8-15)18-13-9-16(10-14-18)5-3-6-19(26(20,21)22)27(23,24)25/h7-14,19H,2-6H2,1H3,(H2,20,21,22)(H2,23,24,25)