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

Systemtic Name: ethyl 1-[2-(8-chloranylnaphthalen-1-yl)sulfanylethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(8-chloro-1-naphthyl)sulfanyl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(8-chloro-1-naphthalenyl)thio]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(8-chloronaphthalen-1-yl)sulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(8-chloro-1-naphthyl)thio]acetyl]isonipecotic acid ethyl ester Formula: C20H22ClNO3S MolecularWeight: 391.91158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClNO3S/c1-2-25-20(24)15-9-11-22(12-10-15)18(23)13-26-17-8-4-6-14-5-3-7-16(21)19(14)17/h3-8,15H,2,9-13H2,1H3