(3R)-1-(4-fluoranyl-3,5-dimethyl-phenyl)sulfonyl-3-(pyrrol-1-ylmethyl)piperidine

Systemtic Name: (3R)-1-(4-fluoranyl-3,5-dimethyl-phenyl)sulfonyl-3-(pyrrol-1-ylmethyl)piperidine Openeye Name: (3R)-1-(4-fluoro-3,5-dimethyl-phenyl)sulfonyl-3-(pyrrol-1-ylmethyl)piperidine CAS Name: (3R)-1-(4-fluoro-3,5-dimethylphenyl)sulfonyl-3-(1-pyrrolylmethyl)piperidine IUPAC Name: (3R)-1-(4-fluoro-3,5-dimethylphenyl)sulfonyl-3-(pyrrol-1-ylmethyl)piperidine Traditional Name: (3R)-1-(4-fluoro-3,5-dimethyl-phenyl)sulfonyl-3-(pyrrol-1-ylmethyl)piperidine Formula: C18H23FN2O2S MolecularWeight: 350.450823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1F)C)S(=O)(=O)N2CCCC(C2)CN3C=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1F)C)S(=O)(=O)N2CCC[C@@H](C2)CN3C=CC=C3

InChI

InChI=1S/C18H23FN2O2S/c1-14-10-17(11-15(2)18(14)19)24(22,23)21-9-5-6-16(13-21)12-20-7-3-4-8-20/h3-4,7-8,10-11,16H,5-6,9,12-13H2,1-2H3/t16-/m1/s1