2-[[4-(butanoylamino)phenyl]carbonylamino]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[[4-(butanoylamino)phenyl]carbonylamino]ethyl-diethyl-azanium chloride Openeye Name: 2-[[4-(butanoylamino)benzoyl]amino]ethyl-diethyl-ammonium chloride CAS Name: diethyl-[2-[[oxo-[4-(1-oxobutylamino)phenyl]methyl]amino]ethyl]ammonium chloride IUPAC Name: 2-[[4-(butanoylamino)benzoyl]amino]ethyl-diethylazanium chloride Traditional Name: 2-[(4-butyramidobenzoyl)amino]ethyl-diethyl-ammonium chloride Formula: C17H28ClN3O2 MolecularWeight: 341.87612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)NCC[NH+](CC)CC.[Cl-]

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)NCC[NH+](CC)CC.[Cl-]

InChI

InChI=1S/C17H27N3O2.ClH/c1-4-7-16(21)19-15-10-8-14(9-11-15)17(22)18-12-13-20(5-2)6-3;/h8-11H,4-7,12-13H2,1-3H3,(H,18,22)(H,19,21);1H