[(2R)-2-[(1S)-1-cyano-3,4-dihydroisochromen-1-yl]propyl]-diethyl-azanium

Systemtic Name: [(2R)-2-[(1S)-1-cyano-3,4-dihydroisochromen-1-yl]propyl]-diethyl-azanium Openeye Name: [(2R)-2-[(1S)-1-cyanoisochroman-1-yl]propyl]-diethyl-ammonium CAS Name: [(2R)-2-[(1S)-1-cyano-3,4-dihydro-1H-2-benzopyran-1-yl]propyl]-diethylammonium IUPAC Name: [(2R)-2-[(1S)-1-cyano-3,4-dihydroisochromen-1-yl]propyl]-diethylazanium Traditional Name: [(2R)-2-[(1S)-1-cyanoisochroman-1-yl]propyl]-diethyl-ammonium Formula: C17H25N2O+ MolecularWeight: 273.3932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(C)C1(C2=CC=CC=C2CCO1)C#N

Isomeric SMILES

CC[NH+](CC)C[C@@H](C)[C@]1(C2=CC=CC=C2CCO1)C#N

InChI

InChI=1S/C17H24N2O/c1-4-19(5-2)12-14(3)17(13-18)16-9-7-6-8-15(16)10-11-20-17/h6-9,14H,4-5,10-12H2,1-3H3/p+1/t14-,17+/m1/s1