2-[(5-chloranyl-1-methyl-imidazol-2-yl)methoxy]-5-nitro-benzoic acid

Systemtic Name: 2-[(5-chloranyl-1-methyl-imidazol-2-yl)methoxy]-5-nitro-benzoic acid Openeye Name: 2-[(5-chloro-1-methyl-imidazol-2-yl)methoxy]-5-nitro-benzoic acid CAS Name: 2-[(5-chloro-1-methyl-2-imidazolyl)methoxy]-5-nitrobenzoic acid IUPAC Name: 2-[(5-chloro-1-methylimidazol-2-yl)methoxy]-5-nitrobenzoic acid Traditional Name: 2-[(5-chloro-1-methyl-imidazol-2-yl)methoxy]-5-nitro-benzoic acid Formula: C12H10ClN3O5 MolecularWeight: 311.6779

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)Cl

Isomeric SMILES

CN1C(=CN=C1COC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)Cl

InChI

InChI=1S/C12H10ClN3O5/c1-15-10(13)5-14-11(15)6-21-9-3-2-7(16(19)20)4-8(9)12(17)18/h2-5H,6H2,1H3,(H,17,18)