[2-phenyl-3-(phenylsulfonylamino)propyl] benzenesulfonate

Systemtic Name: [2-phenyl-3-(phenylsulfonylamino)propyl] benzenesulfonate Openeye Name: [3-(benzenesulfonamido)-2-phenyl-propyl] benzenesulfonate CAS Name: benzenesulfonic acid [3-(benzenesulfonamido)-2-phenylpropyl] ester IUPAC Name: [3-(benzenesulfonamido)-2-phenylpropyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-(benzenesulfonamido)-2-phenyl-propyl] ester Formula: C21H21NO5S2 MolecularWeight: 431.52514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC=C2)COS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=CC=C2)COS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO5S2/c23-28(24,20-12-6-2-7-13-20)22-16-19(18-10-4-1-5-11-18)17-27-29(25,26)21-14-8-3-9-15-21/h1-15,19,22H,16-17H2