3-[1-(2,1,3-benzoxadiazol-5-ylmethyl)piperidin-3-yl]-N-(5-chloranyl-2-methoxy-phenyl)propanamide

Systemtic Name: 3-[1-(2,1,3-benzoxadiazol-5-ylmethyl)piperidin-3-yl]-N-(5-chloranyl-2-methoxy-phenyl)propanamide Openeye Name: 3-[1-(2,1,3-benzoxadiazol-5-ylmethyl)-3-piperidyl]-N-(5-chloro-2-methoxy-phenyl)propanamide CAS Name: 3-[1-(2,1,3-benzoxadiazol-5-ylmethyl)-3-piperidinyl]-N-(5-chloro-2-methoxyphenyl)propanamide IUPAC Name: 3-[1-(2,1,3-benzoxadiazol-5-ylmethyl)piperidin-3-yl]-N-(5-chloro-2-methoxyphenyl)propanamide Traditional Name: 3-[1-(benzofurazan-5-ylmethyl)-3-piperidyl]-N-(5-chloro-2-methoxy-phenyl)propionamide Formula: C22H25ClN4O3 MolecularWeight: 428.9119

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCC2CCCN(C2)CC3=CC4=NON=C4C=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCC2CCCN(C2)CC3=CC4=NON=C4C=C3

InChI

InChI=1S/C22H25ClN4O3/c1-29-21-8-6-17(23)12-20(21)24-22(28)9-5-15-3-2-10-27(13-15)14-16-4-7-18-19(11-16)26-30-25-18/h4,6-8,11-12,15H,2-3,5,9-10,13-14H2,1H3,(H,24,28)