4-(bromomethyl)-2-[(2-methylpropan-2-yl)oxy]-3-nitro-benzamide

Systemtic Name: 4-(bromomethyl)-2-[(2-methylpropan-2-yl)oxy]-3-nitro-benzamide Openeye Name: 4-(bromomethyl)-2-tert-butoxy-3-nitro-benzamide CAS Name: 4-(bromomethyl)-2-[(2-methylpropan-2-yl)oxy]-3-nitrobenzamide IUPAC Name: 4-(bromomethyl)-2-[(2-methylpropan-2-yl)oxy]-3-nitrobenzamide Traditional Name: 4-(bromomethyl)-2-tert-butoxy-3-nitro-benzamide Formula: C12H15BrN2O4 MolecularWeight: 331.1625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=C(C=CC(=C1[N+](=O)[O-])CBr)C(=O)N

Isomeric SMILES

CC(C)(C)OC1=C(C=CC(=C1[N+](=O)[O-])CBr)C(=O)N

InChI

InChI=1S/C12H15BrN2O4/c1-12(2,3)19-10-8(11(14)16)5-4-7(6-13)9(10)15(17)18/h4-5H,6H2,1-3H3,(H2,14,16)