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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N4O8/c1-4(9(14)15)10-8-6(12(18)19)2-5(11(16)17)3-7(8)13(20)21/h2-4,10H,1H3,(H,14,15)/t4-/m0/s1