2-[[ethyl-[phenyl(sulfo)methyl]amino]-diphenyl-methyl]benzenesulfonic acid

Systemtic Name: 2-[[ethyl-[phenyl(sulfo)methyl]amino]-diphenyl-methyl]benzenesulfonic acid Openeye Name: 2-[[ethyl-[phenyl(sulfo)methyl]amino]-diphenyl-methyl]benzenesulfonic acid CAS Name: 2-[[ethyl-[phenyl(sulfo)methyl]amino]-diphenylmethyl]benzenesulfonic acid IUPAC Name: 2-[[ethyl-[phenyl(sulfo)methyl]amino]-diphenylmethyl]benzenesulfonic acid Traditional Name: 2-[[ethyl-[phenyl(sulfo)methyl]amino]-diphenyl-methyl]besylic acid Formula: C28H27NO6S2 MolecularWeight: 537.64708

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C1=CC=CC=C1)S(=O)(=O)O)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4S(=O)(=O)O

Isomeric SMILES

CCN(C(C1=CC=CC=C1)S(=O)(=O)O)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4S(=O)(=O)O

InChI

InChI=1S/C28H27NO6S2/c1-2-29(27(37(33,34)35)22-14-6-3-7-15-22)28(23-16-8-4-9-17-23,24-18-10-5-11-19-24)25-20-12-13-21-26(25)36(30,31)32/h3-21,27H,2H2,1H3,(H,30,31,32)(H,33,34,35)