N-[(4-butoxy-3-methoxy-phenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-butoxy-3-methoxy-benzyl)-1-(3,4-dimethylphenyl)sulfonyl-isonipecotamide Formula: C26H36N2O5S MolecularWeight: 488.63944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C)OC

InChI

InChI=1S/C26H36N2O5S/c1-5-6-15-33-24-10-8-21(17-25(24)32-4)18-27-26(29)22-11-13-28(14-12-22)34(30,31)23-9-7-19(2)20(3)16-23/h7-10,16-17,22H,5-6,11-15,18H2,1-4H3,(H,27,29)