[4-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propanoylamino]phenyl]methylazanium

Systemtic Name: [4-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propanoylamino]phenyl]methylazanium Openeye Name: [4-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propanoylamino]phenyl]methylammonium CAS Name: [4-[[3-(2-methyl-1H-imidazol-3-ium-3-yl)-1-oxopropyl]amino]phenyl]methylammonium IUPAC Name: [4-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propanoylamino]phenyl]methylazanium Traditional Name: [4-[3-(2-methyl-1H-imidazol-3-ium-3-yl)propanoylamino]benzyl]ammonium Formula: C14H20N4O+2 MolecularWeight: 260.3348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1)CCC(=O)NC2=CC=C(C=C2)C[NH3+]

Isomeric SMILES

CC1=[N+](C=CN1)CCC(=O)NC2=CC=C(C=C2)C[NH3+]

InChI

InChI=1S/C14H18N4O/c1-11-16-7-9-18(11)8-6-14(19)17-13-4-2-12(10-15)3-5-13/h2-5,7,9H,6,8,10,15H2,1H3,(H,17,19)/p+2