[(1S)-1-(2-chloranyl-3-propan-2-yl-quinolin-6-yl)ethyl]azanium

Systemtic Name: [(1S)-1-(2-chloranyl-3-propan-2-yl-quinolin-6-yl)ethyl]azanium Openeye Name: [(1S)-1-(2-chloro-3-isopropyl-6-quinolyl)ethyl]ammonium CAS Name: [(1S)-1-(2-chloro-3-propan-2-yl-6-quinolinyl)ethyl]ammonium IUPAC Name: [(1S)-1-(2-chloro-3-propan-2-ylquinolin-6-yl)ethyl]azanium Traditional Name: [(1S)-1-(2-chloro-3-isopropyl-6-quinolyl)ethyl]ammonium Formula: C14H18ClN2+ MolecularWeight: 249.75912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=C2C=CC(=CC2=C1)C(C)[NH3+])Cl

Isomeric SMILES

C[C@@H](C1=CC2=CC(=C(N=C2C=C1)Cl)C(C)C)[NH3+]

InChI

InChI=1S/C14H17ClN2/c1-8(2)12-7-11-6-10(9(3)16)4-5-13(11)17-14(12)15/h4-9H,16H2,1-3H3/p+1/t9-/m0/s1