2-(2,2-dimethylpropanoylamino)-3-(4-nitrophenyl)propanoic acid

Systemtic Name: 2-(2,2-dimethylpropanoylamino)-3-(4-nitrophenyl)propanoic acid Openeye Name: 2-(2,2-dimethylpropanoylamino)-3-(4-nitrophenyl)propanoic acid CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-3-(4-nitrophenyl)propanoic acid IUPAC Name: 2-(2,2-dimethylpropanoylamino)-3-(4-nitrophenyl)propanoic acid Traditional Name: 3-(4-nitrophenyl)-2-(pivaloylamino)propionic acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H18N2O5/c1-14(2,3)13(19)15-11(12(17)18)8-9-4-6-10(7-5-9)16(20)21/h4-7,11H,8H2,1-3H3,(H,15,19)(H,17,18)