(1-azanyl-1-oxidanylidene-propan-2-yl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC(C(=O)N)OC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

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