1-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-N-(5-chloranyl-2-oxidanyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-N-(5-chloranyl-2-oxidanyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-N-(5-chloro-2-hydroxy-phenyl)piperidine-4-carboxamide CAS Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N-(5-chloro-2-hydroxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N-(5-chloro-2-hydroxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-N-(5-chloro-2-hydroxy-phenyl)isonipecotamide Formula: C21H22ClN3O5 MolecularWeight: 431.86948

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)O)CC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)O)CC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22ClN3O5/c22-14-1-3-17(26)16(9-14)24-21(28)13-5-7-25(8-6-13)11-20(27)23-15-2-4-18-19(10-15)30-12-29-18/h1-4,9-10,13,26H,5-8,11-12H2,(H,23,27)(H,24,28)