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

Systemtic Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-pentan-1-one Openeye Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-pentan-1-one CAS Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-1-pentanone IUPAC Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpentan-1-one Traditional Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-pentan-1-one Formula: C15H21NO MolecularWeight: 231.33334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@H](C)C(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C15H21NO/c1-3-6-12(2)15(17)16-10-9-13-7-4-5-8-14(13)11-16/h4-5,7-8,12H,3,6,9-11H2,1-2H3/t12-/m0/s1