3-[2-methylpropanoyl-(4-propan-2-ylphenyl)amino]propylazanium

Systemtic Name: 3-[2-methylpropanoyl-(4-propan-2-ylphenyl)amino]propylazanium Openeye Name: 3-[4-isopropyl-N-(2-methylpropanoyl)anilino]propylammonium CAS Name: 3-(N-(2-methyl-1-oxopropyl)-4-propan-2-ylanilino)propylammonium IUPAC Name: 3-[N-(2-methylpropanoyl)-4-propan-2-ylanilino]propylazanium Traditional Name: 3-(N-isobutyryl-4-isopropyl-anilino)propylammonium Formula: C16H27N2O+ MolecularWeight: 263.39838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O/c1-12(2)14-6-8-15(9-7-14)18(11-5-10-17)16(19)13(3)4/h6-9,12-13H,5,10-11,17H2,1-4H3/p+1