[(4S)-4-[(7-chloranylquinolin-1-ium-4-yl)amino]pentyl]-ethyl-(2-hydroxyethyl)azanium

Systemtic Name: [(4S)-4-[(7-chloranylquinolin-1-ium-4-yl)amino]pentyl]-ethyl-(2-hydroxyethyl)azanium Openeye Name: [(4S)-4-[(7-chloroquinolin-1-ium-4-yl)amino]pentyl]-ethyl-(2-hydroxyethyl)ammonium CAS Name: [(4S)-4-[(7-chloro-4-quinolin-1-iumyl)amino]pentyl]-ethyl-(2-hydroxyethyl)ammonium IUPAC Name: [(4S)-4-[(7-chloroquinolin-1-ium-4-yl)amino]pentyl]-ethyl-(2-hydroxyethyl)azanium Traditional Name: [(4S)-4-[(7-chloroquinolin-1-ium-4-yl)amino]pentyl]-ethyl-(2-hydroxyethyl)ammonium Formula: C18H28ClN3O+2 MolecularWeight: 337.88742

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCC(C)NC1=C2C=CC(=CC2=[NH+]C=C1)Cl)CCO

Isomeric SMILES

CC[NH+](CCC[C@H](C)NC1=C2C=CC(=CC2=[NH+]C=C1)Cl)CCO

InChI

InChI=1S/C18H26ClN3O/c1-3-22(11-12-23)10-4-5-14(2)21-17-8-9-20-18-13-15(19)6-7-16(17)18/h6-9,13-14,23H,3-5,10-12H2,1-2H3,(H,20,21)/p+2/t14-/m0/s1