5-[[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]methyl]-3-(phenylmethyl)-1,3-oxazinan-2-one

Systemtic Name: 5-[[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]methyl]-3-(phenylmethyl)-1,3-oxazinan-2-one Openeye Name: 3-benzyl-5-[[4-[(2-bromo-5-methoxy-phenyl)methyl]-1-piperidyl]methyl]-1,3-oxazinan-2-one CAS Name: 5-[[4-[(2-bromo-5-methoxyphenyl)methyl]-1-piperidinyl]methyl]-3-(phenylmethyl)-1,3-oxazinan-2-one IUPAC Name: 3-benzyl-5-[[4-[(2-bromo-5-methoxyphenyl)methyl]piperidin-1-yl]methyl]-1,3-oxazinan-2-one Traditional Name: 3-benzyl-5-[[4-(2-bromo-5-methoxy-benzyl)piperidino]methyl]-1,3-oxazinan-2-one Formula: C25H31BrN2O3 MolecularWeight: 487.42924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3CN(C(=O)OC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3CN(C(=O)OC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H31BrN2O3/c1-30-23-7-8-24(26)22(14-23)13-19-9-11-27(12-10-19)15-21-17-28(25(29)31-18-21)16-20-5-3-2-4-6-20/h2-8,14,19,21H,9-13,15-18H2,1H3