N-(4-aminocarbonylphenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-aminocarbonylphenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-carbamoylphenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(4-carbamoylphenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-carbamoylphenyl)-1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-carbamoylphenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-isonipecotamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O6S/c1-29-18-8-7-17(13-19(18)30-2)31(27,28)24-11-9-15(10-12-24)21(26)23-16-5-3-14(4-6-16)20(22)25/h3-8,13,15H,9-12H2,1-2H3,(H2,22,25)(H,23,26)