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

Systemtic Name: [3-[[4-(azaniumylmethyl)phenyl]amino]-3-oxidanylidene-propyl]-dimethyl-azanium Openeye Name: [3-[4-(azaniumylmethyl)anilino]-3-oxo-propyl]-dimethyl-ammonium CAS Name: [3-[4-(ammoniomethyl)anilino]-3-oxopropyl]-dimethylammonium IUPAC Name: [3-[4-(azaniumylmethyl)anilino]-3-oxopropyl]-dimethylazanium Traditional Name: [3-[4-(ammoniomethyl)anilino]-3-keto-propyl]-dimethyl-ammonium Formula: C12H21N3O+2 MolecularWeight: 223.31464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC(=O)NC1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

C[NH+](C)CCC(=O)NC1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C12H19N3O/c1-15(2)8-7-12(16)14-11-5-3-10(9-13)4-6-11/h3-6H,7-9,13H2,1-2H3,(H,14,16)/p+2