N-(2-chloranyl-4,5-dimethoxy-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(2-chloranyl-4,5-dimethoxy-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(2-chloro-4,5-dimethoxy-phenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(2-chloro-4,5-dimethoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(2-chloro-4,5-dimethoxyphenyl)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(2-chloro-4,5-dimethoxy-phenyl)-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C21H25ClN2O6S MolecularWeight: 468.951

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC(=C(C=C3Cl)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC(=C(C=C3Cl)OC)OC

InChI

InChI=1S/C21H25ClN2O6S/c1-28-15-6-8-16(9-7-15)31(26,27)24-10-4-5-14(13-24)21(25)23-18-12-20(30-3)19(29-2)11-17(18)22/h6-9,11-12,14H,4-5,10,13H2,1-3H3,(H,23,25)