[1-(2,1,3-benzoxadiazol-5-ylmethyl)piperidin-3-yl]-(4-methoxy-2-methyl-phenyl)methanone

Systemtic Name: [1-(2,1,3-benzoxadiazol-5-ylmethyl)piperidin-3-yl]-(4-methoxy-2-methyl-phenyl)methanone Openeye Name: [1-(2,1,3-benzoxadiazol-5-ylmethyl)-3-piperidyl]-(4-methoxy-2-methyl-phenyl)methanone CAS Name: [1-(2,1,3-benzoxadiazol-5-ylmethyl)-3-piperidinyl]-(4-methoxy-2-methylphenyl)methanone IUPAC Name: [1-(2,1,3-benzoxadiazol-5-ylmethyl)piperidin-3-yl]-(4-methoxy-2-methylphenyl)methanone Traditional Name: [1-(benzofurazan-5-ylmethyl)-3-piperidyl]-(4-methoxy-2-methyl-phenyl)methanone Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)C2CCCN(C2)CC3=CC4=NON=C4C=C3

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)C2CCCN(C2)CC3=CC4=NON=C4C=C3

InChI

InChI=1S/C21H23N3O3/c1-14-10-17(26-2)6-7-18(14)21(25)16-4-3-9-24(13-16)12-15-5-8-19-20(11-15)23-27-22-19/h5-8,10-11,16H,3-4,9,12-13H2,1-2H3