3-[[1-[2-bis(3-sulfophenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-(3-sulfophenyl)phosphanyl]benzenesulfonic acid

Systemtic Name: 3-[[1-[2-bis(3-sulfophenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-(3-sulfophenyl)phosphanyl]benzenesulfonic acid Openeye Name: 3-[[1-[2-bis(3-sulfophenyl)phosphanyl-1-naphthyl]-2-naphthyl]-(3-sulfophenyl)phosphanyl]benzenesulfonic acid CAS Name: 3-[[1-[2-bis(3-sulfophenyl)phosphino-1-naphthalenyl]-2-naphthalenyl]-(3-sulfophenyl)phosphino]benzenesulfonic acid IUPAC Name: 3-[[1-[2-bis(3-sulfophenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-(3-sulfophenyl)phosphanyl]benzenesulfonic acid Traditional Name: 3-[[1-[2-bis(3-sulfophenyl)phosphino-1-naphthyl]-2-naphthyl]-(3-sulfophenyl)phosphino]besylic acid Formula: C44H32O12P2S4 MolecularWeight: 942.925202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)P(C5=CC(=CC=C5)S(=O)(=O)O)C6=CC(=CC=C6)S(=O)(=O)O)P(C7=CC(=CC=C7)S(=O)(=O)O)C8=CC(=CC=C8)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)P(C5=CC(=CC=C5)S(=O)(=O)O)C6=CC(=CC=C6)S(=O)(=O)O)P(C7=CC(=CC=C7)S(=O)(=O)O)C8=CC(=CC=C8)S(=O)(=O)O

InChI

InChI=1S/C44H32O12P2S4/c45-59(46,47)35-15-5-11-31(25-35)57(32-12-6-16-36(26-32)60(48,49)50)41-23-21-29-9-1-3-19-39(29)43(41)44-40-20-4-2-10-30(40)22-24-42(44)58(33-13-7-17-37(27-33)61(51,52)53)34-14-8-18-38(28-34)62(54,55)56/h1-28H,(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56)