methyl 2-[[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]carbonyl-methyl-amino]benzoate

Systemtic Name: methyl 2-[[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]carbonyl-methyl-amino]benzoate Openeye Name: methyl 2-[[1-(2-fluorophenyl)sulfonylpiperidine-4-carbonyl]-methyl-amino]benzoate CAS Name: 2-[[[1-(2-fluorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]-methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[[1-(2-fluorophenyl)sulfonylpiperidine-4-carbonyl]-methylamino]benzoate Traditional Name: 2-[[1-(2-fluorophenyl)sulfonylisonipecotoyl]-methyl-amino]benzoic acid methyl ester Formula: C21H23FN2O5S MolecularWeight: 434.481123

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OC)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OC)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H23FN2O5S/c1-23(18-9-5-3-7-16(18)21(26)29-2)20(25)15-11-13-24(14-12-15)30(27,28)19-10-6-4-8-17(19)22/h3-10,15H,11-14H2,1-2H3