[5-imidazo[1,2-a]pyridin-3-yl-2-(2-methylpropanoyloxy)-3-nitro-phenyl] 2-methylpropanoate

Systemtic Name: [5-imidazo[1,2-a]pyridin-3-yl-2-(2-methylpropanoyloxy)-3-nitro-phenyl] 2-methylpropanoate Openeye Name: [5-imidazo[1,2-a]pyridin-3-yl-2-(2-methylpropanoyloxy)-3-nitro-phenyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [5-(3-imidazo[1,2-a]pyridinyl)-2-(2-methyl-1-oxopropoxy)-3-nitrophenyl] ester IUPAC Name: [5-imidazo[1,2-a]pyridin-3-yl-2-(2-methylpropanoyloxy)-3-nitrophenyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid (5-imidazo[1,2-a]pyridin-3-yl-2-isobutyryloxy-3-nitro-phenyl) ester Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1=CC(=CC(=C1OC(=O)C(C)C)[N+](=O)[O-])C2=CN=C3N2C=CC=C3

Isomeric SMILES

CC(C)C(=O)OC1=CC(=CC(=C1OC(=O)C(C)C)[N+](=O)[O-])C2=CN=C3N2C=CC=C3

InChI

InChI=1S/C21H21N3O6/c1-12(2)20(25)29-17-10-14(16-11-22-18-7-5-6-8-23(16)18)9-15(24(27)28)19(17)30-21(26)13(3)4/h5-13H,1-4H3