4-[(7-chloranylquinolin-1-ium-4-yl)amino]butylazanium

Systemtic Name: 4-[(7-chloranylquinolin-1-ium-4-yl)amino]butylazanium Openeye Name: 4-[(7-chloroquinolin-1-ium-4-yl)amino]butylammonium CAS Name: 4-[(7-chloro-4-quinolin-1-iumyl)amino]butylammonium IUPAC Name: 4-[(7-chloroquinolin-1-ium-4-yl)amino]butylazanium Traditional Name: 4-[(7-chloroquinolin-1-ium-4-yl)amino]butylammonium Formula: C13H18ClN3+2 MolecularWeight: 251.75512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C[NH+]=C2C=C1Cl)NCCCC[NH3+]

Isomeric SMILES

C1=CC2=C(C=C[NH+]=C2C=C1Cl)NCCCC[NH3+]

InChI

InChI=1S/C13H16ClN3/c14-10-3-4-11-12(16-7-2-1-6-15)5-8-17-13(11)9-10/h3-5,8-9H,1-2,6-7,15H2,(H,16,17)/p+2