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

Systemtic Name: 5-[[4-[(2-bromanyl-5-propan-2-yloxy-phenyl)methyl]piperidin-1-yl]methyl]-3-(4-methoxyphenyl)-1,3-oxazinan-2-one Openeye Name: 5-[[4-[(2-bromo-5-isopropoxy-phenyl)methyl]-1-piperidyl]methyl]-3-(4-methoxyphenyl)-1,3-oxazinan-2-one CAS Name: 5-[[4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]-1-piperidinyl]methyl]-3-(4-methoxyphenyl)-1,3-oxazinan-2-one IUPAC Name: 5-[[4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]piperidin-1-yl]methyl]-3-(4-methoxyphenyl)-1,3-oxazinan-2-one Traditional Name: 5-[[4-(2-bromo-5-isopropoxy-benzyl)piperidino]methyl]-3-(4-methoxyphenyl)-1,3-oxazinan-2-one Formula: C27H35BrN2O4 MolecularWeight: 531.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3CN(C(=O)OC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3CN(C(=O)OC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H35BrN2O4/c1-19(2)34-25-8-9-26(28)22(15-25)14-20-10-12-29(13-11-20)16-21-17-30(27(31)33-18-21)23-4-6-24(32-3)7-5-23/h4-9,15,19-21H,10-14,16-18H2,1-3H3