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

Systemtic Name: 5-[[4-[(2-bromanyl-5-ethoxy-phenyl)methyl]piperidin-1-yl]methyl]-3-(phenylmethyl)-1,3-oxazinan-2-one Openeye Name: 3-benzyl-5-[[4-[(2-bromo-5-ethoxy-phenyl)methyl]-1-piperidyl]methyl]-1,3-oxazinan-2-one CAS Name: 5-[[4-[(2-bromo-5-ethoxyphenyl)methyl]-1-piperidinyl]methyl]-3-(phenylmethyl)-1,3-oxazinan-2-one IUPAC Name: 3-benzyl-5-[[4-[(2-bromo-5-ethoxyphenyl)methyl]piperidin-1-yl]methyl]-1,3-oxazinan-2-one Traditional Name: 3-benzyl-5-[[4-(2-bromo-5-ethoxy-benzyl)piperidino]methyl]-1,3-oxazinan-2-one Formula: C26H33BrN2O3 MolecularWeight: 501.45582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3CN(C(=O)OC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3CN(C(=O)OC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H33BrN2O3/c1-2-31-24-8-9-25(27)23(15-24)14-20-10-12-28(13-11-20)16-22-18-29(26(30)32-19-22)17-21-6-4-3-5-7-21/h3-9,15,20,22H,2,10-14,16-19H2,1H3