[(1S)-2,3-dihydro-1H-inden-1-yl] 1-(4-chlorophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [(1S)-2,3-dihydro-1H-inden-1-yl] 1-(4-chlorophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [(1S)-indan-1-yl] 1-(4-chlorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-4-piperidinecarboxylic acid [(1S)-2,3-dihydro-1H-inden-1-yl] ester IUPAC Name: [(1S)-2,3-dihydro-1H-inden-1-yl] 1-(4-chlorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylisonipecotic acid [(1S)-indan-1-yl] ester Formula: C21H22ClNO4S MolecularWeight: 419.92168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C1OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC2=CC=CC=C2[C@H]1OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClNO4S/c22-17-6-8-18(9-7-17)28(25,26)23-13-11-16(12-14-23)21(24)27-20-10-5-15-3-1-2-4-19(15)20/h1-4,6-9,16,20H,5,10-14H2/t20-/m0/s1