2-nitro-6-[1-oxidanidyl-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenol

Systemtic Name: 2-nitro-6-[1-oxidanidyl-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenol Openeye Name: 2-nitro-6-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenol CAS Name: 2-nitro-6-[1-oxido-2-[(E)-prop-1-enyl]-1-imidazol-1-iumyl]phenol IUPAC Name: 2-nitro-6-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenol Traditional Name: 2-nitro-6-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenol Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=NC=C[N+]1(C2=CC=CC(=C2O)[N+](=O)[O-])[O-]

Isomeric SMILES

C/C=C/C1=NC=C[N+]1(C2=CC=CC(=C2O)[N+](=O)[O-])[O-]

InChI

InChI=1S/C12H11N3O4/c1-2-4-11-13-7-8-15(11,19)10-6-3-5-9(12(10)16)14(17)18/h2-8,16H,1H3/b4-2+