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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31BrN2O3/c1-2-30-23-8-9-24(26)21(15-23)14-19-10-12-27(13-11-19)16-20-17-28(25(29)31-18-20)22-6-4-3-5-7-22/h3-9,15,19-20H,2,10-14,16-18H2,1H3