(4-piperidin-1-ylcarbonylphenyl) 2,5-dimethylbenzenesulfonate

Systemtic Name: (4-piperidin-1-ylcarbonylphenyl) 2,5-dimethylbenzenesulfonate Openeye Name: [4-(piperidine-1-carbonyl)phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[oxo(1-piperidinyl)methyl]phenyl] ester IUPAC Name: [4-(piperidine-1-carbonyl)phenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-(piperidine-1-carbonyl)phenyl] ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)N3CCCCC3

InChI

InChI=1S/C20H23NO4S/c1-15-6-7-16(2)19(14-15)26(23,24)25-18-10-8-17(9-11-18)20(22)21-12-4-3-5-13-21/h6-11,14H,3-5,12-13H2,1-2H3