N-(3-chloranyl-4-propan-2-yloxy-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-propan-2-yloxy-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-isopropoxy-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-chloro-4-propan-2-yloxyphenyl)-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-propan-2-yloxyphenyl)-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-4-isopropoxy-phenyl)-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C22H27ClN2O5S/c1-15(2)30-21-9-4-17(14-20(21)23)24-22(26)16-10-12-25(13-11-16)31(27,28)19-7-5-18(29-3)6-8-19/h4-9,14-16H,10-13H2,1-3H3,(H,24,26)