[2-[(3R)-3-aminocarbonylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: [2-[(3R)-3-aminocarbonylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-naphthalen-2-ylsulfanylethanoate Openeye Name: [2-[(3R)-3-carbamoyl-1-piperidyl]-2-oxo-ethyl] 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid [2-[(3R)-3-carbamoyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(3R)-3-carbamoylpiperidin-1-yl]-2-oxoethyl] 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid [2-[(3R)-3-carbamoylpiperidino]-2-keto-ethyl] ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)COC(=O)CSC2=CC3=CC=CC=C3C=C2)C(=O)N

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)COC(=O)CSC2=CC3=CC=CC=C3C=C2)C(=O)N

InChI

InChI=1S/C20H22N2O4S/c21-20(25)16-6-3-9-22(11-16)18(23)12-26-19(24)13-27-17-8-7-14-4-1-2-5-15(14)10-17/h1-2,4-5,7-8,10,16H,3,6,9,11-13H2,(H2,21,25)/t16-/m1/s1