methyl 2-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]ethanoate

Systemtic Name: methyl 2-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]ethanoate Openeye Name: methyl 2-[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]acetate CAS Name: 2-[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]acetate Traditional Name: 2-[3-(4-piperidinosulfonylphenyl)propanoylamino]acetic acid methyl ester Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

COC(=O)CNC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C17H24N2O5S/c1-24-17(21)13-18-16(20)10-7-14-5-8-15(9-6-14)25(22,23)19-11-3-2-4-12-19/h5-6,8-9H,2-4,7,10-13H2,1H3,(H,18,20)