[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-[3-(methylazaniumyl)propyl]azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-[3-(methylazaniumyl)propyl]azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-[3-(methylammonio)propyl]ammonium CAS Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-[3-(methylammonio)propyl]ammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-[3-(methylazaniumyl)propyl]azanium Traditional Name: [4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-[3-(methylammonio)propyl]ammonium Formula: C14H25N3O3+2 MolecularWeight: 283.3666

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCC[NH2+]CC1=CC(=C(C=C1)OCC(=O)N)OC

Isomeric SMILES

C[NH2+]CCC[NH2+]CC1=CC(=C(C=C1)OCC(=O)N)OC

InChI

InChI=1S/C14H23N3O3/c1-16-6-3-7-17-9-11-4-5-12(13(8-11)19-2)20-10-14(15)18/h4-5,8,16-17H,3,6-7,9-10H2,1-2H3,(H2,15,18)/p+2