[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-propyl]ammonium CAS Name: [(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-propyl]ammonium Formula: C14H21N2O+ MolecularWeight: 233.32934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC2=CC=CC=C2C1)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC2=CC=CC=C2C1)[NH3+]

InChI

InChI=1S/C14H20N2O/c1-10(2)13(15)14(17)16-8-7-11-5-3-4-6-12(11)9-16/h3-6,10,13H,7-9,15H2,1-2H3/p+1/t13-/m0/s1