1-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[5-(azepan-1-ylsulfonyl)-2-methoxy-benzoyl]piperidine-4-carboxamide CAS Name: 1-[[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[5-(azepan-1-ylsulfonyl)-2-methoxybenzoyl]piperidine-4-carboxamide Traditional Name: 1-[5-(azepan-1-ylsulfonyl)-2-methoxy-benzoyl]isonipecotamide Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C20H29N3O5S/c1-28-18-7-6-16(29(26,27)23-10-4-2-3-5-11-23)14-17(18)20(25)22-12-8-15(9-13-22)19(21)24/h6-7,14-15H,2-5,8-13H2,1H3,(H2,21,24)