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

Systemtic Name: ethyl 1-[2-[(4-bromophenyl)sulfonyl-ethyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(4-bromophenyl)sulfonyl-ethyl-amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(4-bromophenyl)sulfonyl-ethylamino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-bromophenyl)sulfonyl-ethylamino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[brosyl(ethyl)amino]acetyl]isonipecotic acid ethyl ester Formula: C18H25BrN2O5S MolecularWeight: 461.3705

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N1CCC(CC1)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCN(CC(=O)N1CCC(CC1)C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H25BrN2O5S/c1-3-21(27(24,25)16-7-5-15(19)6-8-16)13-17(22)20-11-9-14(10-12-20)18(23)26-4-2/h5-8,14H,3-4,9-13H2,1-2H3