phenyl 2-methyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: phenyl 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: phenyl 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid phenyl ester IUPAC Name: phenyl 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid phenyl ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4S/c1-15-10-11-17(25(22,23)20-12-6-3-7-13-20)14-18(15)19(21)24-16-8-4-2-5-9-16/h2,4-5,8-11,14H,3,6-7,12-13H2,1H3