2-[2-[4-(azaniumylmethyl)phenoxy]ethanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-[4-(azaniumylmethyl)phenoxy]ethanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-[4-(azaniumylmethyl)phenoxy]acetyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-[4-(ammoniomethyl)phenoxy]-1-oxoethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-[4-(azaniumylmethyl)phenoxy]acetyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-[4-(ammoniomethyl)phenoxy]acetyl]amino]ethyl-dimethyl-ammonium Formula: C13H23N3O2+2 MolecularWeight: 253.34062

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)COC1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

C[NH+](C)CCNC(=O)COC1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C13H21N3O2/c1-16(2)8-7-15-13(17)10-18-12-5-3-11(9-14)4-6-12/h3-6H,7-10,14H2,1-2H3,(H,15,17)/p+2