[3-[2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanoylamino]phenyl]methylazanium

Systemtic Name: [3-[2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanoylamino]phenyl]methylazanium Openeye Name: [3-[[2-(2-isopropyl-1H-imidazol-3-ium-3-yl)acetyl]amino]phenyl]methylammonium CAS Name: [3-[[1-oxo-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethyl]amino]phenyl]methylammonium IUPAC Name: [3-[[2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)acetyl]amino]phenyl]methylazanium Traditional Name: [3-[[2-(2-isopropyl-1H-imidazol-3-ium-3-yl)acetyl]amino]benzyl]ammonium Formula: C15H22N4O+2 MolecularWeight: 274.36138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C=CN1)CC(=O)NC2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

CC(C)C1=[N+](C=CN1)CC(=O)NC2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C15H20N4O/c1-11(2)15-17-6-7-19(15)10-14(20)18-13-5-3-4-12(8-13)9-16/h3-8,11H,9-10,16H2,1-2H3,(H,18,20)/p+2