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

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 3,4,5-triacetyloxybenzoate Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 3,4,5-triacetoxybenzoate CAS Name: 3,4,5-triacetyloxybenzoic acid 2-(2-methyl-5-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl 3,4,5-triacetyloxybenzoate Traditional Name: 3,4,5-triacetoxybenzoic acid 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl ester Formula: C19H19N3O10 MolecularWeight: 449.36826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O10/c1-10-20-9-17(22(27)28)21(10)5-6-29-19(26)14-7-15(30-11(2)23)18(32-13(4)25)16(8-14)31-12(3)24/h7-9H,5-6H2,1-4H3