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

Systemtic Name: methyl 2-[3-(phenylsulfonyl)propanoylamino]ethanoate Openeye Name: methyl 2-[3-(benzenesulfonyl)propanoylamino]acetate CAS Name: 2-[[3-(benzenesulfonyl)-1-oxopropyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[3-(benzenesulfonyl)propanoylamino]acetate Traditional Name: 2-(3-besylpropanoylamino)acetic acid methyl ester Formula: C12H15NO5S MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO5S/c1-18-12(15)9-13-11(14)7-8-19(16,17)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,13,14)