2-[1-oxidanidyl-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]aniline

Systemtic Name: 2-[1-oxidanidyl-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]aniline Openeye Name: 2-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]aniline CAS Name: 2-[1-oxido-2-[(E)-prop-1-enyl]-1-imidazol-1-iumyl]aniline IUPAC Name: 2-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]aniline Traditional Name: [2-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenyl]amine Formula: C12H13N3O MolecularWeight: 215.25112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=NC=C[N+]1(C2=CC=CC=C2N)[O-]

Isomeric SMILES

C/C=C/C1=NC=C[N+]1(C2=CC=CC=C2N)[O-]

InChI

InChI=1S/C12H13N3O/c1-2-5-12-14-8-9-15(12,16)11-7-4-3-6-10(11)13/h2-9H,13H2,1H3/b5-2+