(4-ethanoylphenyl) 2-methyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (4-ethanoylphenyl) 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (4-acetylphenyl) 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid (4-acetylphenyl) ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H23NO5S/c1-15-6-11-19(28(25,26)22-12-4-3-5-13-22)14-20(15)21(24)27-18-9-7-17(8-10-18)16(2)23/h6-11,14H,3-5,12-13H2,1-2H3