[4-(thiophen-2-ylmethylamino)phenyl] 3-(4-phosphanylphenyl)sulfonylbenzenesulfonate

Systemtic Name: [4-(thiophen-2-ylmethylamino)phenyl] 3-(4-phosphanylphenyl)sulfonylbenzenesulfonate Openeye Name: [4-(2-thienylmethylamino)phenyl] 3-(4-phosphanylphenyl)sulfonylbenzenesulfonate CAS Name: 3-(4-phosphinophenyl)sulfonylbenzenesulfonic acid [4-(thiophen-2-ylmethylamino)phenyl] ester IUPAC Name: [4-(thiophen-2-ylmethylamino)phenyl] 3-(4-phosphanylphenyl)sulfonylbenzenesulfonate Traditional Name: 3-(4-phosphinophenyl)sulfonylbenzenesulfonic acid [4-(2-thenylamino)phenyl] ester Formula: C23H20NO5PS3 MolecularWeight: 517.577361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC=C(C=C2)NCC3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)P

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC=C(C=C2)NCC3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)P

InChI

InChI=1S/C23H20NO5PS3/c25-32(26,21-12-10-19(30)11-13-21)22-4-1-5-23(15-22)33(27,28)29-18-8-6-17(7-9-18)24-16-20-3-2-14-31-20/h1-15,24H,16,30H2