5-[(4-chloranyl-2-methoxy-phenoxy)methyl]-N-(oxan-4-ylmethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(4-chloranyl-2-methoxy-phenoxy)methyl]-N-(oxan-4-ylmethyl)-1,2-oxazole-3-carboxamide Openeye Name: 5-[(4-chloro-2-methoxy-phenoxy)methyl]-N-(tetrahydropyran-4-ylmethyl)isoxazole-3-carboxamide CAS Name: 5-[(4-chloro-2-methoxyphenoxy)methyl]-N-(4-oxanylmethyl)-3-isoxazolecarboxamide IUPAC Name: 5-[(4-chloro-2-methoxyphenoxy)methyl]-N-(oxan-4-ylmethyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-[(4-chloro-2-methoxy-phenoxy)methyl]-N-(tetrahydropyran-4-ylmethyl)isoxazole-3-carboxamide Formula: C18H21ClN2O5 MolecularWeight: 380.82274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)Cl)OCC2=CC(=NO2)C(=O)NCC3CCOCC3

Isomeric SMILES

COC1=C(C=CC(=C1)Cl)OCC2=CC(=NO2)C(=O)NCC3CCOCC3

InChI

InChI=1S/C18H21ClN2O5/c1-23-17-8-13(19)2-3-16(17)25-11-14-9-15(21-26-14)18(22)20-10-12-4-6-24-7-5-12/h2-3,8-9,12H,4-7,10-11H2,1H3,(H,20,22)