2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(3-chloranyl-2-methyl-phenyl)propanamide

Systemtic Name: 2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(3-chloranyl-2-methyl-phenyl)propanamide Openeye Name: 2-[3-(1,3-benzoxazol-2-yl)-1-piperidyl]-N-(3-chloro-2-methyl-phenyl)propanamide CAS Name: 2-[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-N-(3-chloro-2-methylphenyl)propanamide IUPAC Name: 2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(3-chloro-2-methylphenyl)propanamide Traditional Name: 2-[3-(1,3-benzoxazol-2-yl)piperidino]-N-(3-chloro-2-methyl-phenyl)propionamide Formula: C22H24ClN3O2 MolecularWeight: 397.89786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(C)N2CCCC(C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C(C)N2CCCC(C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C22H24ClN3O2/c1-14-17(23)8-5-10-18(14)24-21(27)15(2)26-12-6-7-16(13-26)22-25-19-9-3-4-11-20(19)28-22/h3-5,8-11,15-16H,6-7,12-13H2,1-2H3,(H,24,27)