(3,5-ditert-butyl-4-methoxy-phenyl)-[4-[(4-fluorophenyl)sulfonylmethyl]piperidin-1-yl]methanone

Systemtic Name: (3,5-ditert-butyl-4-methoxy-phenyl)-[4-[(4-fluorophenyl)sulfonylmethyl]piperidin-1-yl]methanone Openeye Name: (3,5-ditert-butyl-4-methoxy-phenyl)-[4-[(4-fluorophenyl)sulfonylmethyl]-1-piperidyl]methanone CAS Name: (3,5-ditert-butyl-4-methoxyphenyl)-[4-[(4-fluorophenyl)sulfonylmethyl]-1-piperidinyl]methanone IUPAC Name: (3,5-ditert-butyl-4-methoxyphenyl)-[4-[(4-fluorophenyl)sulfonylmethyl]piperidin-1-yl]methanone Traditional Name: (3,5-ditert-butyl-4-methoxy-phenyl)-[4-[(4-fluorophenyl)sulfonylmethyl]piperidino]methanone Formula: C28H38FNO4S MolecularWeight: 503.669023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(=O)N2CCC(CC2)CS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(=O)N2CCC(CC2)CS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C28H38FNO4S/c1-27(2,3)23-16-20(17-24(25(23)34-7)28(4,5)6)26(31)30-14-12-19(13-15-30)18-35(32,33)22-10-8-21(29)9-11-22/h8-11,16-17,19H,12-15,18H2,1-7H3