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

Systemtic Name: azepan-1-yl-[5-[(2-chloranyl-4-methoxy-phenoxy)methyl]-1,2-oxazol-3-yl]methanone Openeye Name: azepan-1-yl-[5-[(2-chloro-4-methoxy-phenoxy)methyl]isoxazol-3-yl]methanone CAS Name: 1-azepanyl-[5-[(2-chloro-4-methoxyphenoxy)methyl]-3-isoxazolyl]methanone IUPAC Name: azepan-1-yl-[5-[(2-chloro-4-methoxyphenoxy)methyl]-1,2-oxazol-3-yl]methanone Traditional Name: azepan-1-yl-[5-[(2-chloro-4-methoxy-phenoxy)methyl]isoxazol-3-yl]methanone Formula: C18H21ClN2O4 MolecularWeight: 364.82334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC2=CC(=NO2)C(=O)N3CCCCCC3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OCC2=CC(=NO2)C(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C18H21ClN2O4/c1-23-13-6-7-17(15(19)10-13)24-12-14-11-16(20-25-14)18(22)21-8-4-2-3-5-9-21/h6-7,10-11H,2-5,8-9,12H2,1H3