(phenylmethyl) 2-[3-(phenylsulfonyl)propanoylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-(phenylsulfonyl)propanoylamino]ethanoate Openeye Name: benzyl 2-[3-(benzenesulfonyl)propanoylamino]acetate CAS Name: 2-[[3-(benzenesulfonyl)-1-oxopropyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-(benzenesulfonyl)propanoylamino]acetate Traditional Name: 2-(3-besylpropanoylamino)acetic acid benzyl ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CNC(=O)CCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CNC(=O)CCS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19NO5S/c20-17(11-12-25(22,23)16-9-5-2-6-10-16)19-13-18(21)24-14-15-7-3-1-4-8-15/h1-10H,11-14H2,(H,19,20)