ethyl 1-[2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[m-tolylmethyl(p-tolylsulfonyl)amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(3-methylphenyl)methyl-(4-methylphenyl)sulfonylamino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(3-methylbenzyl)-tosyl-amino]acetyl]isonipecotic acid ethyl ester Formula: C25H32N2O5S MolecularWeight: 472.59698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N2O5S/c1-4-32-25(29)22-12-14-26(15-13-22)24(28)18-27(17-21-7-5-6-20(3)16-21)33(30,31)23-10-8-19(2)9-11-23/h5-11,16,22H,4,12-15,17-18H2,1-3H3