1-[4-[3-[3-[(2-bromanyl-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]propyl]piperidin-1-yl]propan-1-one

Systemtic Name: 1-[4-[3-[3-[(2-bromanyl-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]propyl]piperidin-1-yl]propan-1-one Openeye Name: 1-[4-[3-[3-[(2-bromo-5-methoxy-phenyl)methyl]pyrrolidin-1-yl]propyl]-1-piperidyl]propan-1-one CAS Name: 1-[4-[3-[3-[(2-bromo-5-methoxyphenyl)methyl]-1-pyrrolidinyl]propyl]-1-piperidinyl]-1-propanone IUPAC Name: 1-[4-[3-[3-[(2-bromo-5-methoxyphenyl)methyl]pyrrolidin-1-yl]propyl]piperidin-1-yl]propan-1-one Traditional Name: 1-[4-[3-[3-(2-bromo-5-methoxy-benzyl)pyrrolidino]propyl]piperidino]propan-1-one Formula: C23H35BrN2O2 MolecularWeight: 451.4402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC(CC1)CCCN2CCC(C2)CC3=C(C=CC(=C3)OC)Br

Isomeric SMILES

CCC(=O)N1CCC(CC1)CCCN2CCC(C2)CC3=C(C=CC(=C3)OC)Br

InChI

InChI=1S/C23H35BrN2O2/c1-3-23(27)26-13-9-18(10-14-26)5-4-11-25-12-8-19(17-25)15-20-16-21(28-2)6-7-22(20)24/h6-7,16,18-19H,3-5,8-15,17H2,1-2H3