3-[[4-(azaniumylmethyl)phenyl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(azaniumylmethyl)phenyl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[4-(azaniumylmethyl)benzoyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-(ammoniomethyl)phenyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-(azaniumylmethyl)benzoyl]amino]propyl-dimethylazanium Traditional Name: 3-[[4-(ammoniomethyl)benzoyl]amino]propyl-dimethyl-ammonium Formula: C13H23N3O+2 MolecularWeight: 237.34122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O/c1-16(2)9-3-8-15-13(17)12-6-4-11(10-14)5-7-12/h4-7H,3,8-10,14H2,1-2H3,(H,15,17)/p+2