(3-methyl-2-nitro-imidazol-4-yl)methyl 2-oxidanylbenzoate

Systemtic Name: (3-methyl-2-nitro-imidazol-4-yl)methyl 2-oxidanylbenzoate Openeye Name: (3-methyl-2-nitro-imidazol-4-yl)methyl 2-hydroxybenzoate CAS Name: 2-hydroxybenzoic acid (3-methyl-2-nitro-4-imidazolyl)methyl ester IUPAC Name: (3-methyl-2-nitroimidazol-4-yl)methyl 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid (3-methyl-2-nitro-imidazol-4-yl)methyl ester Formula: C12H11N3O5 MolecularWeight: 277.23284

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1[N+](=O)[O-])COC(=O)C2=CC=CC=C2O

Isomeric SMILES

CN1C(=CN=C1[N+](=O)[O-])COC(=O)C2=CC=CC=C2O

InChI

InChI=1S/C12H11N3O5/c1-14-8(6-13-12(14)15(18)19)7-20-11(17)9-4-2-3-5-10(9)16/h2-6,16H,7H2,1H3