3-(3-bromanyl-4-methoxy-phenyl)-1-(2-pyridin-4-ylpyrrolidin-1-yl)propan-1-one

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)-1-(2-pyridin-4-ylpyrrolidin-1-yl)propan-1-one Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-1-[2-(4-pyridyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(3-bromo-4-methoxyphenyl)-1-(2-pyridin-4-yl-1-pyrrolidinyl)-1-propanone IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-1-(2-pyridin-4-ylpyrrolidin-1-yl)propan-1-one Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-1-[2-(4-pyridyl)pyrrolidino]propan-1-one Formula: C19H21BrN2O2 MolecularWeight: 389.28624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN2O2/c1-24-18-6-4-14(13-16(18)20)5-7-19(23)22-12-2-3-17(22)15-8-10-21-11-9-15/h4,6,8-11,13,17H,2-3,5,7,12H2,1H3