[4-(4-fluorophenyl)carbonylphenyl] 4-methoxy-3-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzoate

Systemtic Name: [4-(4-fluorophenyl)carbonylphenyl] 4-methoxy-3-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzoate Openeye Name: [4-(4-fluorobenzoyl)phenyl] 4-methoxy-3-[[(2R)-2-methyl-1-piperidyl]sulfonyl]benzoate CAS Name: 4-methoxy-3-[[(2R)-2-methyl-1-piperidinyl]sulfonyl]benzoic acid [4-[(4-fluorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-fluorobenzoyl)phenyl] 4-methoxy-3-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzoate Traditional Name: 4-methoxy-3-[(2R)-2-methylpiperidino]sulfonyl-benzoic acid [4-(4-fluorobenzoyl)phenyl] ester Formula: C27H26FNO6S MolecularWeight: 511.561843

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)F)OC

Isomeric SMILES

C[C@@H]1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C27H26FNO6S/c1-18-5-3-4-16-29(18)36(32,33)25-17-21(10-15-24(25)34-2)27(31)35-23-13-8-20(9-14-23)26(30)19-6-11-22(28)12-7-19/h6-15,17-18H,3-5,16H2,1-2H3/t18-/m1/s1