[5-[(7-chloranylquinolin-1-ium-4-yl)amino]-2-oxidanyl-phenyl]methyl-ethyl-(methylamino)azanium

Systemtic Name: [5-[(7-chloranylquinolin-1-ium-4-yl)amino]-2-oxidanyl-phenyl]methyl-ethyl-(methylamino)azanium Openeye Name: [5-[(7-chloroquinolin-1-ium-4-yl)amino]-2-hydroxy-phenyl]methyl-ethyl-(methylamino)ammonium CAS Name: [5-[(7-chloro-4-quinolin-1-iumyl)amino]-2-hydroxyphenyl]methyl-ethyl-(methylamino)ammonium IUPAC Name: [5-[(7-chloroquinolin-1-ium-4-yl)amino]-2-hydroxyphenyl]methyl-ethyl-(methylamino)azanium Traditional Name: [5-[(7-chloroquinolin-1-ium-4-yl)amino]-2-hydroxy-benzyl]-ethyl-(methylamino)ammonium Formula: C19H23ClN4O+2 MolecularWeight: 358.86512

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=[NH+]C=C2)Cl)O)NC

Isomeric SMILES

CC[NH+](CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=[NH+]C=C2)Cl)O)NC

InChI

InChI=1S/C19H21ClN4O/c1-3-24(21-2)12-13-10-15(5-7-19(13)25)23-17-8-9-22-18-11-14(20)4-6-16(17)18/h4-11,21,25H,3,12H2,1-2H3,(H,22,23)/p+2