phenacyl 4-[(3S)-3-methylpiperidin-1-yl]sulfonylthiophene-2-carboxylate

Systemtic Name: phenacyl 4-[(3S)-3-methylpiperidin-1-yl]sulfonylthiophene-2-carboxylate Openeye Name: phenacyl 4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]thiophene-2-carboxylate CAS Name: 4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-2-thiophenecarboxylic acid phenacyl ester IUPAC Name: phenacyl 4-[(3S)-3-methylpiperidin-1-yl]sulfonylthiophene-2-carboxylate Traditional Name: 4-[(3S)-3-methylpiperidino]sulfonylthiophene-2-carboxylic acid phenacyl ester Formula: C19H21NO5S2 MolecularWeight: 407.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21NO5S2/c1-14-6-5-9-20(11-14)27(23,24)16-10-18(26-13-16)19(22)25-12-17(21)15-7-3-2-4-8-15/h2-4,7-8,10,13-14H,5-6,9,11-12H2,1H3/t14-/m0/s1