ethyl 1-[2-[(2,5-dimethylphenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(2,5-dimethylphenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[N-(benzenesulfonyl)-2,5-dimethyl-anilino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[N-(benzenesulfonyl)-2,5-dimethylanilino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[N-(benzenesulfonyl)-2,5-dimethylanilino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-besyl-2,5-dimethyl-anilino)acetyl]isonipecotic acid ethyl ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O5S/c1-4-31-24(28)20-12-14-25(15-13-20)23(27)17-26(22-16-18(2)10-11-19(22)3)32(29,30)21-8-6-5-7-9-21/h5-11,16,20H,4,12-15,17H2,1-3H3