2-(2,2-dimethylpropanoylamino)-5-nitro-benzoic acid

Systemtic Name: 2-(2,2-dimethylpropanoylamino)-5-nitro-benzoic acid Openeye Name: 2-(2,2-dimethylpropanoylamino)-5-nitro-benzoic acid CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-5-nitrobenzoic acid IUPAC Name: 2-(2,2-dimethylpropanoylamino)-5-nitrobenzoic acid Traditional Name: 5-nitro-2-(pivaloylamino)benzoic acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H14N2O5/c1-12(2,3)11(17)13-9-5-4-7(14(18)19)6-8(9)10(15)16/h4-6H,1-3H3,(H,13,17)(H,15,16)