3-(3-bromanyl-4-methoxy-phenyl)-1-[2-(3-methoxyphenyl)pyrrolidin-1-yl]propan-1-one

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)-1-[2-(3-methoxyphenyl)pyrrolidin-1-yl]propan-1-one Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-1-[2-(3-methoxyphenyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(3-bromo-4-methoxyphenyl)-1-[2-(3-methoxyphenyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-1-[2-(3-methoxyphenyl)pyrrolidin-1-yl]propan-1-one Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-1-[2-(3-methoxyphenyl)pyrrolidino]propan-1-one Formula: C21H24BrNO3 MolecularWeight: 418.32416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)N2CCCC2C3=CC(=CC=C3)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)N2CCCC2C3=CC(=CC=C3)OC)Br

InChI

InChI=1S/C21H24BrNO3/c1-25-17-6-3-5-16(14-17)19-7-4-12-23(19)21(24)11-9-15-8-10-20(26-2)18(22)13-15/h3,5-6,8,10,13-14,19H,4,7,9,11-12H2,1-2H3