2-[3-bis(2-carboxyphenyl)phosphanylpropyl-(2-carboxyphenyl)phosphanyl]benzoic acid

Systemtic Name: 2-[3-bis(2-carboxyphenyl)phosphanylpropyl-(2-carboxyphenyl)phosphanyl]benzoic acid Openeye Name: 2-[3-bis(2-carboxyphenyl)phosphanylpropyl-(2-carboxyphenyl)phosphanyl]benzoic acid CAS Name: 2-[3-bis(2-carboxyphenyl)phosphinopropyl-(2-carboxyphenyl)phosphino]benzoic acid IUPAC Name: 2-[3-bis(2-carboxyphenyl)phosphanylpropyl-(2-carboxyphenyl)phosphanyl]benzoic acid Traditional Name: 2-[3-bis(2-carboxyphenyl)phosphinopropyl-(2-carboxyphenyl)phosphino]benzoic acid Formula: C31H26O8P2 MolecularWeight: 588.480862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)P(CCCP(C2=CC=CC=C2C(=O)O)C3=CC=CC=C3C(=O)O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)P(CCCP(C2=CC=CC=C2C(=O)O)C3=CC=CC=C3C(=O)O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C31H26O8P2/c32-28(33)20-10-1-5-14-24(20)40(25-15-6-2-11-21(25)29(34)35)18-9-19-41(26-16-7-3-12-22(26)30(36)37)27-17-8-4-13-23(27)31(38)39/h1-8,10-17H,9,18-19H2,(H,32,33)(H,34,35)(H,36,37)(H,38,39)