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

Systemtic Name: 4-[3-[3-[(2-bromanyl-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]propyl]cyclohexan-1-amine Openeye Name: 4-[3-[3-[(2-bromo-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]propyl]cyclohexanamine CAS Name: 4-[3-[3-[(2-bromo-5-methoxyphenyl)methyl]-1-pyrrolidinyl]propyl]-1-cyclohexanamine IUPAC Name: 4-[3-[3-[(2-bromo-5-methoxyphenyl)methyl]pyrrolidin-1-yl]propyl]cyclohexan-1-amine Traditional Name: [4-[3-[3-(2-bromo-5-methoxy-benzyl)pyrrolidino]propyl]cyclohexyl]amine Formula: C21H33BrN2O MolecularWeight: 409.40352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)CC2CCN(C2)CCCC3CCC(CC3)N

Isomeric SMILES

COC1=CC(=C(C=C1)Br)CC2CCN(C2)CCCC3CCC(CC3)N

InChI

InChI=1S/C21H33BrN2O/c1-25-20-8-9-21(22)18(14-20)13-17-10-12-24(15-17)11-2-3-16-4-6-19(23)7-5-16/h8-9,14,16-17,19H,2-7,10-13,15,23H2,1H3