phenyl 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: phenyl 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Openeye Name: phenyl 3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid phenyl ester IUPAC Name: phenyl 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-(3,5-dimethylpiperidino)sulfonylbenzoic acid phenyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=CC=C3)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=CC=C3)C

InChI

InChI=1S/C20H23NO4S/c1-15-11-16(2)14-21(13-15)26(23,24)19-10-6-7-17(12-19)20(22)25-18-8-4-3-5-9-18/h3-10,12,15-16H,11,13-14H2,1-2H3