3-[butanoyl-(2-methylphenyl)amino]propylazanium

Systemtic Name: 3-[butanoyl-(2-methylphenyl)amino]propylazanium Openeye Name: 3-(N-butanoyl-2-methyl-anilino)propylammonium CAS Name: 3-[2-methyl-N-(1-oxobutyl)anilino]propylammonium IUPAC Name: 3-(N-butanoyl-2-methylanilino)propylazanium Traditional Name: 3-(N-butyryl-2-methyl-anilino)propylammonium Formula: C14H23N2O+ MolecularWeight: 235.34522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(CCC[NH3+])C1=CC=CC=C1C

Isomeric SMILES

CCCC(=O)N(CCC[NH3+])C1=CC=CC=C1C

InChI

InChI=1S/C14H22N2O/c1-3-7-14(17)16(11-6-10-15)13-9-5-4-8-12(13)2/h4-5,8-9H,3,6-7,10-11,15H2,1-2H3/p+1