ethyl 1-[2-[methylsulfonyl(phenyl)amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[methylsulfonyl(phenyl)amino]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(N-methylsulfonylanilino)propanoyl]piperidine-4-carboxylate CAS Name: 1-[2-(N-methylsulfonylanilino)-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(N-methylsulfonylanilino)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-mesylanilino)propanoyl]isonipecotic acid ethyl ester Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(C)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(C)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C18H26N2O5S/c1-4-25-18(22)15-10-12-19(13-11-15)17(21)14(2)20(26(3,23)24)16-8-6-5-7-9-16/h5-9,14-15H,4,10-13H2,1-3H3