(E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)but-2-en-1-one

Systemtic Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)but-2-en-1-one Openeye Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)but-2-en-1-one CAS Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-buten-1-one IUPAC Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)but-2-en-1-one Traditional Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)but-2-en-1-one Formula: C13H15NO MolecularWeight: 201.2643

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCC2=CC=CC=C2C1

Isomeric SMILES

C/C=C/C(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C13H15NO/c1-2-5-13(15)14-9-8-11-6-3-4-7-12(11)10-14/h2-7H,8-10H2,1H3/b5-2+