methyl 2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-6-nitro-benzoate

Systemtic Name: methyl 2-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-6-nitro-benzoate Openeye Name: methyl 2-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)-6-nitro-benzoate CAS Name: 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-6-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-6-nitrobenzoate Traditional Name: 2-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-6-nitro-benzoic acid methyl ester Formula: C15H17N3O5 MolecularWeight: 319.31258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C15H17N3O5/c1-8(2)15(3)14(20)16-12(17-15)9-6-5-7-10(18(21)22)11(9)13(19)23-4/h5-8H,1-4H3,(H,16,17,20)