5-bromanyl-2-butyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 5-bromanyl-2-butyl-3,4-dihydroisoquinolin-1-one Openeye Name: 5-bromo-2-butyl-3,4-dihydroisoquinolin-1-one CAS Name: 5-bromo-2-butyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 5-bromo-2-butyl-3,4-dihydroisoquinolin-1-one Traditional Name: 5-bromo-2-butyl-3,4-dihydroisocarbostyril Formula: C13H16BrNO MolecularWeight: 282.17624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC2=C(C1=O)C=CC=C2Br

Isomeric SMILES

CCCCN1CCC2=C(C1=O)C=CC=C2Br

InChI

InChI=1S/C13H16BrNO/c1-2-3-8-15-9-7-10-11(13(15)16)5-4-6-12(10)14/h4-6H,2-3,7-9H2,1H3