(phenylmethyl) 2-methyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (phenylmethyl) 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: benzyl 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid benzyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H23NO4S/c1-16-10-11-18(26(23,24)21-12-6-3-7-13-21)14-19(16)20(22)25-15-17-8-4-2-5-9-17/h2,4-5,8-11,14H,3,6-7,12-13,15H2,1H3