[4-(4-phenylphenyl)-1-phosphono-but-3-ynyl]phosphonic acid

Systemtic Name: [4-(4-phenylphenyl)-1-phosphono-but-3-ynyl]phosphonic acid Openeye Name: [4-(4-phenylphenyl)-1-phosphono-but-3-ynyl]phosphonic acid CAS Name: [4-(4-phenylphenyl)-1-phosphonobut-3-ynyl]phosphonic acid IUPAC Name: [4-(4-phenylphenyl)-1-phosphonobut-3-ynyl]phosphonic acid Traditional Name: [4-(4-phenylphenyl)-1-phosphono-but-3-ynyl]phosphonic acid Formula: C16H16O6P2 MolecularWeight: 366.242162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C#CCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C#CCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C16H16O6P2/c17-23(18,19)16(24(20,21)22)8-4-5-13-9-11-15(12-10-13)14-6-2-1-3-7-14/h1-3,6-7,9-12,16H,8H2,(H2,17,18,19)(H2,20,21,22)