(2,3-dimethyl-5-phenyl-6-phosphono-phenyl)phosphonic acid

Systemtic Name: (2,3-dimethyl-5-phenyl-6-phosphono-phenyl)phosphonic acid Openeye Name: (2,3-dimethyl-5-phenyl-6-phosphono-phenyl)phosphonic acid CAS Name: (2,3-dimethyl-5-phenyl-6-phosphonophenyl)phosphonic acid IUPAC Name: (2,3-dimethyl-5-phenyl-6-phosphonophenyl)phosphonic acid Traditional Name: (2,3-dimethyl-5-phenyl-6-phosphono-phenyl)phosphonic acid Formula: C14H16O6P2 MolecularWeight: 342.220762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C2=CC=CC=C2)P(=O)(O)O)P(=O)(O)O)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C2=CC=CC=C2)P(=O)(O)O)P(=O)(O)O)C

InChI

InChI=1S/C14H16O6P2/c1-9-8-12(11-6-4-3-5-7-11)14(22(18,19)20)13(10(9)2)21(15,16)17/h3-8H,1-2H3,(H2,15,16,17)(H2,18,19,20)