2-[(3-azaniumylidene-3-azanyl-propyl)-phenyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3-azaniumylidene-3-azanyl-propyl)-phenyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-(N-(3-amino-3-azaniumylidene-propyl)anilino)ethyl-dimethyl-ammonium CAS Name: 2-(N-(3-amino-3-iminiopropyl)anilino)ethyl-dimethylammonium IUPAC Name: 2-(N-(3-amino-3-azaniumylidenepropyl)anilino)ethyl-dimethylazanium Traditional Name: 2-(N-(3-amino-3-iminio-propyl)anilino)ethyl-dimethyl-ammonium Formula: C13H24N4+2 MolecularWeight: 236.35646

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(CCC(=[NH2+])N)C1=CC=CC=C1

Isomeric SMILES

C[NH+](C)CCN(CCC(=[NH2+])N)C1=CC=CC=C1

InChI

InChI=1S/C13H22N4/c1-16(2)10-11-17(9-8-13(14)15)12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H3,14,15)/p+2