2-[[4-(2,2-dimethylpropanoylamino)phenyl]carbonylamino]-4-nitro-phenolate

Systemtic Name: 2-[[4-(2,2-dimethylpropanoylamino)phenyl]carbonylamino]-4-nitro-phenolate Openeye Name: 2-[[4-(2,2-dimethylpropanoylamino)benzoyl]amino]-4-nitro-phenolate CAS Name: 2-[[[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]-4-nitrophenolate IUPAC Name: 2-[[4-(2,2-dimethylpropanoylamino)benzoyl]amino]-4-nitrophenolate Traditional Name: 4-nitro-2-[[4-(pivaloylamino)benzoyl]amino]phenolate Formula: C18H18N3O5- MolecularWeight: 356.35262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C18H19N3O5/c1-18(2,3)17(24)19-12-6-4-11(5-7-12)16(23)20-14-10-13(21(25)26)8-9-15(14)22/h4-10,22H,1-3H3,(H,19,24)(H,20,23)/p-1