N-(5-chloranyl-2-methoxy-phenyl)-1-(2,5-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C21H25ClN2O6S/c1-28-16-5-7-19(30-3)20(13-16)31(26,27)24-10-8-14(9-11-24)21(25)23-17-12-15(22)4-6-18(17)29-2/h4-7,12-14H,8-11H2,1-3H3,(H,23,25)