1-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)acetyl]piperidine-4-carboxamide CAS Name: 1-[2-(5-chloro-2-methyl-N-methylsulfonylanilino)-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(5-chloro-2-methyl-N-methylsulfonylanilino)acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-(5-chloro-N-mesyl-2-methyl-anilino)acetyl]isonipecotamide Formula: C16H22ClN3O4S MolecularWeight: 387.88158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CC(=O)N2CCC(CC2)C(=O)N)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CC(=O)N2CCC(CC2)C(=O)N)S(=O)(=O)C

InChI

InChI=1S/C16H22ClN3O4S/c1-11-3-4-13(17)9-14(11)20(25(2,23)24)10-15(21)19-7-5-12(6-8-19)16(18)22/h3-4,9,12H,5-8,10H2,1-2H3,(H2,18,22)