1-[2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3-chloranyl-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[(3-chloro-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[(3-chloro-4-methoxyphenyl)sulfonyl-cyclohexylamino]acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(3-chloro-4-methoxy-phenyl)sulfonyl-cyclohexyl-amino]acetyl]isonipecotamide Formula: C21H30ClN3O5S MolecularWeight: 471.998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)N)C3CCCCC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)N)C3CCCCC3)Cl

InChI

InChI=1S/C21H30ClN3O5S/c1-30-19-8-7-17(13-18(19)22)31(28,29)25(16-5-3-2-4-6-16)14-20(26)24-11-9-15(10-12-24)21(23)27/h7-8,13,15-16H,2-6,9-12,14H2,1H3,(H2,23,27)