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3-[(2,4,6-trinitrophenyl)amino]propanoic acid

3-[(2,4,6-trinitrophenyl)amino]propanoic acid

Systemtic Name:3-[(2,4,6-trinitrophenyl)amino]propanoic acid
Openeye Name:3-(2,4,6-trinitroanilino)propanoic acid
CAS Name:3-(2,4,6-trinitroanilino)propanoic acid
IUPAC Name:3-(2,4,6-trinitroanilino)propanoic acid
Traditional Name:3-(2,4,6-trinitroanilino)propionic acid
Formula: C9H8N4O8
MolecularWeight: 300.18182
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])NCCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])NCCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C9H8N4O8/c14-8(15)1-2-10-9-6(12(18)19)3-5(11(16)17)4-7(9)13(20)21/h3-4,10H,1-2H2,(H,14,15)


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