[4-[(2S)-butan-2-yl]phenyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [4-[(2S)-butan-2-yl]phenyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: [4-[(1S)-1-methylpropyl]phenyl] 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid [4-[(2S)-butan-2-yl]phenyl] ester IUPAC Name: [4-[(2S)-butan-2-yl]phenyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid [4-[(1S)-1-methylpropyl]phenyl] ester Formula: C20H25NO4S2 MolecularWeight: 407.5468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H25NO4S2/c1-3-15(2)16-6-8-18(9-7-16)25-20(22)17-10-12-21(13-11-17)27(23,24)19-5-4-14-26-19/h4-9,14-15,17H,3,10-13H2,1-2H3/t15-/m0/s1