(1-methyl-5-nitro-imidazol-2-yl)methyl 3,4,5-triacetyloxybenzoate

Systemtic Name: (1-methyl-5-nitro-imidazol-2-yl)methyl 3,4,5-triacetyloxybenzoate Openeye Name: (1-methyl-5-nitro-imidazol-2-yl)methyl 3,4,5-triacetoxybenzoate CAS Name: 3,4,5-triacetyloxybenzoic acid (1-methyl-5-nitro-2-imidazolyl)methyl ester IUPAC Name: (1-methyl-5-nitroimidazol-2-yl)methyl 3,4,5-triacetyloxybenzoate Traditional Name: 3,4,5-triacetoxybenzoic acid (1-methyl-5-nitro-imidazol-2-yl)methyl ester Formula: C18H17N3O10 MolecularWeight: 435.34168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=CC(=C1OC(=O)C)OC(=O)C)C(=O)OCC2=NC=C(N2C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC(=CC(=C1OC(=O)C)OC(=O)C)C(=O)OCC2=NC=C(N2C)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O10/c1-9(22)29-13-5-12(6-14(30-10(2)23)17(13)31-11(3)24)18(25)28-8-15-19-7-16(20(15)4)21(26)27/h5-7H,8H2,1-4H3