(2-naphthalen-2-yl-2-oxidanylidene-ethyl) 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate

Systemtic Name: (2-naphthalen-2-yl-2-oxidanylidene-ethyl) 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: [2-(2-naphthyl)-2-oxo-ethyl] 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid [2-(2-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-2-yl-2-oxoethyl) 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid [2-keto-2-(2-naphthyl)ethyl] ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OCC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OCC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H25NO5S/c27-24(22-11-10-20-6-2-3-7-21(20)17-22)18-31-25(28)16-19-8-12-23(13-9-19)32(29,30)26-14-4-1-5-15-26/h2-3,6-13,17H,1,4-5,14-16,18H2