N-[[4-(3-bromophenyl)oxan-4-yl]methyl]-2-(3,4-dimethoxyphenyl)ethanamide

Systemtic Name: N-[[4-(3-bromophenyl)oxan-4-yl]methyl]-2-(3,4-dimethoxyphenyl)ethanamide Openeye Name: N-[[4-(3-bromophenyl)tetrahydropyran-4-yl]methyl]-2-(3,4-dimethoxyphenyl)acetamide CAS Name: N-[[4-(3-bromophenyl)-4-oxanyl]methyl]-2-(3,4-dimethoxyphenyl)acetamide IUPAC Name: N-[[4-(3-bromophenyl)oxan-4-yl]methyl]-2-(3,4-dimethoxyphenyl)acetamide Traditional Name: N-[[4-(3-bromophenyl)tetrahydropyran-4-yl]methyl]-2-(3,4-dimethoxyphenyl)acetamide Formula: C22H26BrNO4 MolecularWeight: 448.35014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NCC2(CCOCC2)C3=CC(=CC=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NCC2(CCOCC2)C3=CC(=CC=C3)Br)OC

InChI

InChI=1S/C22H26BrNO4/c1-26-19-7-6-16(12-20(19)27-2)13-21(25)24-15-22(8-10-28-11-9-22)17-4-3-5-18(23)14-17/h3-7,12,14H,8-11,13,15H2,1-2H3,(H,24,25)