4-[2-[3-[(2-bromanyl-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]ethyl]cyclohexan-1-amine

Systemtic Name: 4-[2-[3-[(2-bromanyl-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]ethyl]cyclohexan-1-amine Openeye Name: 4-[2-[3-[(2-bromo-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]ethyl]cyclohexanamine CAS Name: 4-[2-[3-[(2-bromo-5-methoxyphenyl)methyl]-1-pyrrolidinyl]ethyl]-1-cyclohexanamine IUPAC Name: 4-[2-[3-[(2-bromo-5-methoxyphenyl)methyl]pyrrolidin-1-yl]ethyl]cyclohexan-1-amine Traditional Name: [4-[2-[3-(2-bromo-5-methoxy-benzyl)pyrrolidino]ethyl]cyclohexyl]amine Formula: C20H31BrN2O MolecularWeight: 395.37694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)CC2CCN(C2)CCC3CCC(CC3)N

Isomeric SMILES

COC1=CC(=C(C=C1)Br)CC2CCN(C2)CCC3CCC(CC3)N

InChI

InChI=1S/C20H31BrN2O/c1-24-19-6-7-20(21)17(13-19)12-16-9-11-23(14-16)10-8-15-2-4-18(22)5-3-15/h6-7,13,15-16,18H,2-5,8-12,14,22H2,1H3