2-[4-[(6-azanylpyridin-1-ium-3-yl)amino]phenyl]carbonyloxyethyl-diethyl-azanium

Systemtic Name: 2-[4-[(6-azanylpyridin-1-ium-3-yl)amino]phenyl]carbonyloxyethyl-diethyl-azanium Openeye Name: 2-[4-[(6-aminopyridin-1-ium-3-yl)amino]benzoyl]oxyethyl-diethyl-ammonium CAS Name: 2-[[4-[(6-amino-3-pyridin-1-iumyl)amino]phenyl]-oxomethoxy]ethyl-diethylammonium IUPAC Name: 2-[4-[(6-aminopyridin-1-ium-3-yl)amino]benzoyl]oxyethyl-diethylazanium Traditional Name: 2-[4-[(6-aminopyridin-1-ium-3-yl)amino]benzoyl]oxyethyl-diethyl-ammonium Formula: C18H26N4O2+2 MolecularWeight: 330.42464

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)NC2=C[NH+]=C(C=C2)N

Isomeric SMILES

CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)NC2=C[NH+]=C(C=C2)N

InChI

InChI=1S/C18H24N4O2/c1-3-22(4-2)11-12-24-18(23)14-5-7-15(8-6-14)21-16-9-10-17(19)20-13-16/h5-10,13,21H,3-4,11-12H2,1-2H3,(H2,19,20)/p+2