azepan-1-yl-[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methanone

Systemtic Name: azepan-1-yl-[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methanone Openeye Name: azepan-1-yl-[3-(3,4-dimethoxyphenyl)-4,5-dihydroisoxazol-5-yl]methanone CAS Name: 1-azepanyl-[3-(3,4-dimethoxyphenyl)-4,5-dihydroisoxazol-5-yl]methanone IUPAC Name: azepan-1-yl-[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methanone Traditional Name: azepan-1-yl-[3-(3,4-dimethoxyphenyl)-2-isoxazolin-5-yl]methanone Formula: C18H24N2O4 MolecularWeight: 332.39416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(C2)C(=O)N3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(C2)C(=O)N3CCCCCC3)OC

InChI

InChI=1S/C18H24N2O4/c1-22-15-8-7-13(11-16(15)23-2)14-12-17(24-19-14)18(21)20-9-5-3-4-6-10-20/h7-8,11,17H,3-6,9-10,12H2,1-2H3