2-[[(2,4-dinitrophenyl)amino]carbamoyl]-3-nitro-benzoic acid

Systemtic Name: 2-[[(2,4-dinitrophenyl)amino]carbamoyl]-3-nitro-benzoic acid Openeye Name: 2-[(2,4-dinitroanilino)carbamoyl]-3-nitro-benzoic acid CAS Name: 2-[[(2,4-dinitrophenyl)hydrazo]-oxomethyl]-3-nitrobenzoic acid IUPAC Name: 2-[(2,4-dinitroanilino)carbamoyl]-3-nitrobenzoic acid Traditional Name: 2-[(2,4-dinitroanilino)carbamoyl]-3-nitro-benzoic acid Formula: C14H9N5O9 MolecularWeight: 391.24936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H9N5O9/c20-13(12-8(14(21)22)2-1-3-10(12)18(25)26)16-15-9-5-4-7(17(23)24)6-11(9)19(27)28/h1-6,15H,(H,16,20)(H,21,22)