ethyl 1-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)propanoyl]piperidine-4-carboxylate CAS Name: 1-[2-(5-chloro-2-methyl-N-methylsulfonylanilino)-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(5-chloro-2-methyl-N-methylsulfonylanilino)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(5-chloro-N-mesyl-2-methyl-anilino)propanoyl]isonipecotic acid ethyl ester Formula: C19H27ClN2O5S MolecularWeight: 430.94608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(C)N(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(C)N(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C

InChI

InChI=1S/C19H27ClN2O5S/c1-5-27-19(24)15-8-10-21(11-9-15)18(23)14(3)22(28(4,25)26)17-12-16(20)7-6-13(17)2/h6-7,12,14-15H,5,8-11H2,1-4H3