1-(3,4,4a,8a-tetrahydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one

Systemtic Name: 1-(3,4,4a,8a-tetrahydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one Openeye Name: 1-(3,4,4a,8a-tetrahydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one CAS Name: 1-(3,4,4a,8a-tetrahydro-1H-isoquinolin-2-yl)-3-methyl-1-butanone IUPAC Name: 1-(3,4,4a,8a-tetrahydro-1H-isoquinolin-2-yl)-3-methylbutan-1-one Traditional Name: 1-(3,4,4a,8a-tetrahydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one Formula: C14H21NO MolecularWeight: 219.32264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2C=CC=CC2C1

Isomeric SMILES

CC(C)CC(=O)N1CCC2C=CC=CC2C1

InChI

InChI=1S/C14H21NO/c1-11(2)9-14(16)15-8-7-12-5-3-4-6-13(12)10-15/h3-6,11-13H,7-10H2,1-2H3