2-azanyl-2-methyl-3-(3-nitro-4-oxidanyl-phenyl)propanoic acid

Systemtic Name: 2-azanyl-2-methyl-3-(3-nitro-4-oxidanyl-phenyl)propanoic acid Openeye Name: 2-amino-3-(4-hydroxy-3-nitro-phenyl)-2-methyl-propanoic acid CAS Name: 2-amino-3-(4-hydroxy-3-nitrophenyl)-2-methylpropanoic acid IUPAC Name: 2-amino-3-(4-hydroxy-3-nitrophenyl)-2-methylpropanoic acid Traditional Name: 2-amino-3-(4-hydroxy-3-nitro-phenyl)-2-methyl-propionic acid Formula: C10H12N2O5 MolecularWeight: 240.21268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O5/c1-10(11,9(14)15)5-6-2-3-8(13)7(4-6)12(16)17/h2-4,13H,5,11H2,1H3,(H,14,15)