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

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-butan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-butan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-1-butanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylbutan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-butan-1-one Formula: C14H19NO MolecularWeight: 217.30676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO/c1-3-11(2)14(16)15-9-8-12-6-4-5-7-13(12)10-15/h4-7,11H,3,8-10H2,1-2H3