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

Systemtic Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-but-2-en-1-one Openeye Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-but-2-en-1-one CAS Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-2-buten-1-one IUPAC Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylbut-2-en-1-one Traditional Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-but-2-en-1-one Formula: C14H17NO MolecularWeight: 215.29088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO/c1-3-11(2)14(16)15-9-8-12-6-4-5-7-13(12)10-15/h3-7H,8-10H2,1-2H3/b11-3+