methyl 1-[2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(N-methylsulfonyl-4-propoxy-anilino)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(N-methylsulfonyl-4-propoxyanilino)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(N-methylsulfonyl-4-propoxyanilino)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-mesyl-4-propoxy-anilino)acetyl]isonipecotic acid methyl ester Formula: C19H28N2O6S MolecularWeight: 412.50042

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N(CC(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)N(CC(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C19H28N2O6S/c1-4-13-27-17-7-5-16(6-8-17)21(28(3,24)25)14-18(22)20-11-9-15(10-12-20)19(23)26-2/h5-8,15H,4,9-14H2,1-3H3