[(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-butyl]ammonium CAS Name: [(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-butyl]ammonium Formula: C17H27N2O3+ MolecularWeight: 307.40788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O3/c1-11(2)7-14(18)17(20)19-6-5-12-8-15(21-3)16(22-4)9-13(12)10-19/h8-9,11,14H,5-7,10,18H2,1-4H3/p+1/t14-/m0/s1