4-(phenylmethoxycarbonylamino)-3-[3-(phenylsulfonyloxy)phenyl]butanoic acid

Systemtic Name: 4-(phenylmethoxycarbonylamino)-3-[3-(phenylsulfonyloxy)phenyl]butanoic acid Openeye Name: 3-[3-(benzenesulfonyloxy)phenyl]-4-(benzyloxycarbonylamino)butanoic acid CAS Name: 3-[3-(benzenesulfonyloxy)phenyl]-4-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 3-[3-(benzenesulfonyloxy)phenyl]-4-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 4-(benzyloxycarbonylamino)-3-(3-besyloxyphenyl)butyric acid Formula: C24H23NO7S MolecularWeight: 469.50692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC(CC(=O)O)C2=CC(=CC=C2)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC(CC(=O)O)C2=CC(=CC=C2)OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H23NO7S/c26-23(27)15-20(16-25-24(28)31-17-18-8-3-1-4-9-18)19-10-7-11-21(14-19)32-33(29,30)22-12-5-2-6-13-22/h1-14,20H,15-17H2,(H,25,28)(H,26,27)