1-(azepan-1-ylsulfonyl)-N-(5-chloranyl-2,4-dimethoxy-phenyl)piperidine-3-carboxamide

Systemtic Name: 1-(azepan-1-ylsulfonyl)-N-(5-chloranyl-2,4-dimethoxy-phenyl)piperidine-3-carboxamide Openeye Name: 1-(azepan-1-ylsulfonyl)-N-(5-chloro-2,4-dimethoxy-phenyl)piperidine-3-carboxamide CAS Name: 1-(1-azepanylsulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(azepan-1-ylsulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)piperidine-3-carboxamide Traditional Name: 1-(azepan-1-ylsulfonyl)-N-(5-chloro-2,4-dimethoxy-phenyl)nipecotamide Formula: C20H30ClN3O5S MolecularWeight: 459.9873

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2CCCN(C2)S(=O)(=O)N3CCCCCC3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2CCCN(C2)S(=O)(=O)N3CCCCCC3)Cl)OC

InChI

InChI=1S/C20H30ClN3O5S/c1-28-18-13-19(29-2)17(12-16(18)21)22-20(25)15-8-7-11-24(14-15)30(26,27)23-9-5-3-4-6-10-23/h12-13,15H,3-11,14H2,1-2H3,(H,22,25)