[(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: [(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: [(1R)-2-methoxy-2-oxo-1-phenyl-ethyl] 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid [(1R)-2-methoxy-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-methoxy-2-oxo-1-phenylethyl] 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid [(1R)-2-keto-2-methoxy-1-phenyl-ethyl] ester Formula: C23H27NO6S MolecularWeight: 445.52858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)[C@@H](C1=CC=CC=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H27NO6S/c1-29-23(26)22(19-8-4-2-5-9-19)30-21(25)15-12-18-10-13-20(14-11-18)31(27,28)24-16-6-3-7-17-24/h2,4-5,8-11,13-14,22H,3,6-7,12,15-17H2,1H3/t22-/m1/s1