ethyl 1-[2-[2-(8-chloranylnaphthalen-1-yl)sulfanylethanoyloxy]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[2-(8-chloranylnaphthalen-1-yl)sulfanylethanoyloxy]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[2-[(8-chloro-1-naphthyl)sulfanyl]acetyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[2-[(8-chloro-1-naphthalenyl)thio]-1-oxoethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[2-(8-chloronaphthalen-1-yl)sulfanylacetyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[2-[(8-chloro-1-naphthyl)thio]acetyl]oxyacetyl]isonipecotic acid ethyl ester Formula: C22H24ClNO5S MolecularWeight: 449.94766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

InChI

InChI=1S/C22H24ClNO5S/c1-2-28-22(27)16-9-11-24(12-10-16)19(25)13-29-20(26)14-30-18-8-4-6-15-5-3-7-17(23)21(15)18/h3-8,16H,2,9-14H2,1H3