ethyl 1-[2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(2-methyl-N-methylsulfonyl-anilino)acetyl]piperidine-3-carboxylate CAS Name: 1-[2-(2-methyl-N-methylsulfonylanilino)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2-methyl-N-methylsulfonylanilino)acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-(N-mesyl-2-methyl-anilino)acetyl]nipecotic acid ethyl ester Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CN(C2=CC=CC=C2C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CN(C2=CC=CC=C2C)S(=O)(=O)C

InChI

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