tert-butyl 3-[(3-fluorophenyl)methyl-(4-methoxyphenyl)sulfonyl-amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(3-fluorophenyl)methyl-(4-methoxyphenyl)sulfonyl-amino]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(3-fluorophenyl)methyl-(4-methoxyphenyl)sulfonyl-amino]piperidine-1-carboxylate CAS Name: 3-[(3-fluorophenyl)methyl-(4-methoxyphenyl)sulfonylamino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(3-fluorophenyl)methyl-(4-methoxyphenyl)sulfonylamino]piperidine-1-carboxylate Traditional Name: 3-[(3-fluorobenzyl)-(4-methoxyphenyl)sulfonyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H31FN2O5S MolecularWeight: 478.576743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H31FN2O5S/c1-24(2,3)32-23(28)26-14-6-9-20(17-26)27(16-18-7-5-8-19(25)15-18)33(29,30)22-12-10-21(31-4)11-13-22/h5,7-8,10-13,15,20H,6,9,14,16-17H2,1-4H3