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

Systemtic Name: ethyl 1-[2-[(4-ethoxyphenyl)sulfonyl-(4-methylphenyl)amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(N-(4-ethoxyphenyl)sulfonyl-4-methyl-anilino)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(N-(4-ethoxyphenyl)sulfonyl-4-methylanilino)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(N-(4-ethoxyphenyl)sulfonyl-4-methylanilino)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-methyl-N-p-phenetylsulfonyl-anilino)acetyl]isonipecotic acid ethyl ester Formula: C25H32N2O6S MolecularWeight: 488.59638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)OCC)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)OCC)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H32N2O6S/c1-4-32-22-10-12-23(13-11-22)34(30,31)27(21-8-6-19(3)7-9-21)18-24(28)26-16-14-20(15-17-26)25(29)33-5-2/h6-13,20H,4-5,14-18H2,1-3H3