ethyl 1-(8-chloranylnaphthalen-1-yl)sulfonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-(8-chloranylnaphthalen-1-yl)sulfonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[(8-chloro-1-naphthyl)sulfonyl]piperidine-3-carboxylate CAS Name: 1-[(8-chloro-1-naphthalenyl)sulfonyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(8-chloronaphthalen-1-yl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-[(8-chloro-1-naphthyl)sulfonyl]nipecotic acid ethyl ester Formula: C18H20ClNO4S MolecularWeight: 381.8737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC3=C2C(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC3=C2C(=CC=C3)Cl

InChI

InChI=1S/C18H20ClNO4S/c1-2-24-18(21)14-8-5-11-20(12-14)25(22,23)16-10-4-7-13-6-3-9-15(19)17(13)16/h3-4,6-7,9-10,14H,2,5,8,11-12H2,1H3