3-[(4-aminocarbonylphenyl)methylazaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-aminocarbonylphenyl)methylazaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[(4-carbamoylphenyl)methylammonio]propyl-dimethyl-ammonium CAS Name: 3-[(4-carbamoylphenyl)methylammonio]propyl-dimethylammonium IUPAC Name: 3-[(4-carbamoylphenyl)methylazaniumyl]propyl-dimethylazanium Traditional Name: 3-[(4-carbamoylbenzyl)ammonio]propyl-dimethyl-ammonium Formula: C13H23N3O+2 MolecularWeight: 237.34122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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