ethyl 1-[2-[(4-fluorophenyl)sulfonyl-(phenylmethyl)amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(4-fluorophenyl)sulfonyl-(phenylmethyl)amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[benzyl-(4-fluorophenyl)sulfonyl-amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(4-fluorophenyl)sulfonyl-(phenylmethyl)amino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[benzyl-(4-fluorophenyl)sulfonylamino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[benzyl-(4-fluorophenyl)sulfonyl-amino]acetyl]isonipecotic acid ethyl ester Formula: C23H27FN2O5S MolecularWeight: 462.534283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H27FN2O5S/c1-2-31-23(28)19-12-14-25(15-13-19)22(27)17-26(16-18-6-4-3-5-7-18)32(29,30)21-10-8-20(24)9-11-21/h3-11,19H,2,12-17H2,1H3