2-bromanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one

Systemtic Name: 2-bromanyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one Openeye Name: 2-bromo-1-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one CAS Name: 2-bromo-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-butanone IUPAC Name: 2-bromo-1-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one Traditional Name: 2-bromo-1-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one Formula: C13H16BrNO MolecularWeight: 282.17624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCC2=CC=CC=C2C1)Br

Isomeric SMILES

CCC(C(=O)N1CCC2=CC=CC=C2C1)Br

InChI

InChI=1S/C13H16BrNO/c1-2-12(14)13(16)15-8-7-10-5-3-4-6-11(10)9-15/h3-6,12H,2,7-9H2,1H3