4-[2-[4-[(2-bromanyl-5-propan-2-yloxy-phenyl)methyl]piperidin-1-yl]ethyl]-1-cyclohexyl-1,3-diazinan-2-one

Systemtic Name: 4-[2-[4-[(2-bromanyl-5-propan-2-yloxy-phenyl)methyl]piperidin-1-yl]ethyl]-1-cyclohexyl-1,3-diazinan-2-one Openeye Name: 4-[2-[4-[(2-bromo-5-isopropoxy-phenyl)methyl]-1-piperidyl]ethyl]-1-cyclohexyl-hexahydropyrimidin-2-one CAS Name: 4-[2-[4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]-1-piperidinyl]ethyl]-1-cyclohexyl-1,3-diazinan-2-one IUPAC Name: 4-[2-[4-[(2-bromo-5-propan-2-yloxyphenyl)methyl]piperidin-1-yl]ethyl]-1-cyclohexyl-1,3-diazinan-2-one Traditional Name: 4-[2-[4-(2-bromo-5-isopropoxy-benzyl)piperidino]ethyl]-1-cyclohexyl-hexahydropyrimidin-2-one Formula: C27H42BrN3O2 MolecularWeight: 520.54528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCC3CCN(C(=O)N3)C4CCCCC4

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCC3CCN(C(=O)N3)C4CCCCC4

InChI

InChI=1S/C27H42BrN3O2/c1-20(2)33-25-8-9-26(28)22(19-25)18-21-10-14-30(15-11-21)16-12-23-13-17-31(27(32)29-23)24-6-4-3-5-7-24/h8-9,19-21,23-24H,3-7,10-18H2,1-2H3,(H,29,32)