[5-[(4-chloranyl-2-methoxy-phenoxy)methyl]-1,2-oxazol-3-yl]-(2-pyridin-3-ylpiperidin-1-yl)methanone

Systemtic Name: [5-[(4-chloranyl-2-methoxy-phenoxy)methyl]-1,2-oxazol-3-yl]-(2-pyridin-3-ylpiperidin-1-yl)methanone Openeye Name: [5-[(4-chloro-2-methoxy-phenoxy)methyl]isoxazol-3-yl]-[2-(3-pyridyl)-1-piperidyl]methanone CAS Name: [5-[(4-chloro-2-methoxyphenoxy)methyl]-3-isoxazolyl]-[2-(3-pyridinyl)-1-piperidinyl]methanone IUPAC Name: [5-[(4-chloro-2-methoxyphenoxy)methyl]-1,2-oxazol-3-yl]-(2-pyridin-3-ylpiperidin-1-yl)methanone Traditional Name: [5-[(4-chloro-2-methoxy-phenoxy)methyl]isoxazol-3-yl]-[2-(3-pyridyl)piperidino]methanone Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)Cl)OCC2=CC(=NO2)C(=O)N3CCCCC3C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)Cl)OCC2=CC(=NO2)C(=O)N3CCCCC3C4=CN=CC=C4

InChI

InChI=1S/C22H22ClN3O4/c1-28-21-11-16(23)7-8-20(21)29-14-17-12-18(25-30-17)22(27)26-10-3-2-6-19(26)15-5-4-9-24-13-15/h4-5,7-9,11-13,19H,2-3,6,10,14H2,1H3