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

Systemtic Name: 4-nitro-2-[1-oxidanidyl-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenol Openeye Name: 4-nitro-2-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenol CAS Name: 4-nitro-2-[1-oxido-2-[(E)-prop-1-enyl]-1-imidazol-1-iumyl]phenol IUPAC Name: 4-nitro-2-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenol Traditional Name: 4-nitro-2-[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=C(C=CC(=C2)[N+](=O)[O-])O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O4/c1-2-3-12-13-6-7-15(12,19)10-8-9(14(17)18)4-5-11(10)16/h2-8,16H,1H3/b3-2+