2-[4-bis(2-sulfonatophenyl)phosphanylpentan-2-yl-(2-sulfonatophenyl)phosphanyl]benzenesulfonate

Systemtic Name: 2-[4-bis(2-sulfonatophenyl)phosphanylpentan-2-yl-(2-sulfonatophenyl)phosphanyl]benzenesulfonate Openeye Name: 2-[[3-bis(2-sulfonatophenyl)phosphanyl-1-methyl-butyl]-(2-sulfonatophenyl)phosphanyl]benzenesulfonate CAS Name: 2-[4-bis(2-sulfonatophenyl)phosphinopentan-2-yl-(2-sulfonatophenyl)phosphino]benzenesulfonate IUPAC Name: 2-[4-bis(2-sulfonatophenyl)phosphanylpentan-2-yl-(2-sulfonatophenyl)phosphanyl]benzenesulfonate Traditional Name: 2-[[3-bis(2-sulfonatophenyl)phosphino-1-methyl-butyl]-(2-sulfonatophenyl)phosphino]besylate Formula: C29H26O12P2S4-4 MolecularWeight: 756.717062

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)P(C1=CC=CC=C1S(=O)(=O)[O-])C2=CC=CC=C2S(=O)(=O)[O-])P(C3=CC=CC=C3S(=O)(=O)[O-])C4=CC=CC=C4S(=O)(=O)[O-]

Isomeric SMILES

CC(CC(C)P(C1=CC=CC=C1S(=O)(=O)[O-])C2=CC=CC=C2S(=O)(=O)[O-])P(C3=CC=CC=C3S(=O)(=O)[O-])C4=CC=CC=C4S(=O)(=O)[O-]

InChI

InChI=1S/C29H30O12P2S4/c1-20(42(22-11-3-7-15-26(22)44(30,31)32)23-12-4-8-16-27(23)45(33,34)35)19-21(2)43(24-13-5-9-17-28(24)46(36,37)38)25-14-6-10-18-29(25)47(39,40)41/h3-18,20-21H,19H2,1-2H3,(H,30,31,32)(H,33,34,35)(H,36,37,38)(H,39,40,41)/p-4