N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]-2-oxidanylidene-ethyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]-2-oxidanylidene-ethyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]-2-oxo-ethyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]-2-oxoethyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]-2-oxoethyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[2-keto-2-[(3-methyl-1H-imidazol-3-ium-2-yl)methylamino]ethyl]phenyl]cyclopropanecarboxamide Formula: C17H21N4O2+ MolecularWeight: 313.37424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)CNC(=O)CC2=CC=C(C=C2)NC(=O)C3CC3

Isomeric SMILES

C[N+]1=C(NC=C1)CNC(=O)CC2=CC=C(C=C2)NC(=O)C3CC3

InChI

InChI=1S/C17H20N4O2/c1-21-9-8-18-15(21)11-19-16(22)10-12-2-6-14(7-3-12)20-17(23)13-4-5-13/h2-3,6-9,13H,4-5,10-11H2,1H3,(H2,19,20,22,23)/p+1