naphthalen-1-ylmethyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: naphthalen-1-ylmethyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: 1-naphthylmethyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid 1-naphthylmethyl ester Formula: C21H21NO4S2 MolecularWeight: 415.52574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H21NO4S2/c23-21(26-15-18-7-3-6-16-5-1-2-8-19(16)18)17-10-12-22(13-11-17)28(24,25)20-9-4-14-27-20/h1-9,14,17H,10-13,15H2