1-(1,3-benzoxazol-2-yl)-N-(5-chloranyl-2,4-dimethoxy-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-(5-chloranyl-2,4-dimethoxy-phenyl)piperidine-4-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-(5-chloro-2,4-dimethoxy-phenyl)piperidine-4-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-(5-chloro-2,4-dimethoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-(5-chloro-2,4-dimethoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-(5-chloro-2,4-dimethoxy-phenyl)isonipecotamide Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)Cl)OC

InChI

InChI=1S/C21H22ClN3O4/c1-27-18-12-19(28-2)16(11-14(18)22)23-20(26)13-7-9-25(10-8-13)21-24-15-5-3-4-6-17(15)29-21/h3-6,11-13H,7-10H2,1-2H3,(H,23,26)