4-(3-bromanyl-4-methoxy-phenyl)-1-(2-oxidanylpyrrolidin-1-yl)butan-1-one

Systemtic Name: 4-(3-bromanyl-4-methoxy-phenyl)-1-(2-oxidanylpyrrolidin-1-yl)butan-1-one Openeye Name: 4-(3-bromo-4-methoxy-phenyl)-1-(2-hydroxypyrrolidin-1-yl)butan-1-one CAS Name: 4-(3-bromo-4-methoxyphenyl)-1-(2-hydroxy-1-pyrrolidinyl)-1-butanone IUPAC Name: 4-(3-bromo-4-methoxyphenyl)-1-(2-hydroxypyrrolidin-1-yl)butan-1-one Traditional Name: 4-(3-bromo-4-methoxy-phenyl)-1-(2-hydroxypyrrolidino)butan-1-one Formula: C15H20BrNO3 MolecularWeight: 342.2282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCCC(=O)N2CCCC2O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCCC(=O)N2CCCC2O)Br

InChI

InChI=1S/C15H20BrNO3/c1-20-13-8-7-11(10-12(13)16)4-2-5-14(18)17-9-3-6-15(17)19/h7-8,10,15,19H,2-6,9H2,1H3