2-oxidanyl-3-[[[2-oxidanyl-3-[[(2-oxidanyl-3-sulfo-phenyl)methylcarbamoylamino]methyl]phenyl]methylcarbamoylamino]methyl]benzenesulfonic acid

Systemtic Name: 2-oxidanyl-3-[[[2-oxidanyl-3-[[(2-oxidanyl-3-sulfo-phenyl)methylcarbamoylamino]methyl]phenyl]methylcarbamoylamino]methyl]benzenesulfonic acid Openeye Name: 2-hydroxy-3-[[[2-hydroxy-3-[[(2-hydroxy-3-sulfo-phenyl)methylcarbamoylamino]methyl]phenyl]methylcarbamoylamino]methyl]benzenesulfonic acid CAS Name: 2-hydroxy-3-[[[[[2-hydroxy-3-[[[[(2-hydroxy-3-sulfophenyl)methylamino]-oxomethyl]amino]methyl]phenyl]methylamino]-oxomethyl]amino]methyl]benzenesulfonic acid IUPAC Name: 2-hydroxy-3-[[[2-hydroxy-3-[[(2-hydroxy-3-sulfophenyl)methylcarbamoylamino]methyl]phenyl]methylcarbamoylamino]methyl]benzenesulfonic acid Traditional Name: 2-hydroxy-3-[[[2-hydroxy-3-[[(2-hydroxy-3-sulfo-benzyl)carbamoylamino]methyl]benzyl]carbamoylamino]methyl]besylic acid Formula: C24H26N4O11S2 MolecularWeight: 610.61344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)CNC(=O)NCC2=C(C(=CC=C2)S(=O)(=O)O)O)O)CNC(=O)NCC3=C(C(=CC=C3)S(=O)(=O)O)O

Isomeric SMILES

C1=CC(=C(C(=C1)CNC(=O)NCC2=C(C(=CC=C2)S(=O)(=O)O)O)O)CNC(=O)NCC3=C(C(=CC=C3)S(=O)(=O)O)O

InChI

InChI=1S/C24H26N4O11S2/c29-20-14(10-25-23(32)27-12-16-6-2-8-18(21(16)30)40(34,35)36)4-1-5-15(20)11-26-24(33)28-13-17-7-3-9-19(22(17)31)41(37,38)39/h1-9,29-31H,10-13H2,(H2,25,27,32)(H2,26,28,33)(H,34,35,36)(H,37,38,39)