N2,N3-bis(2,4,6-trinitrophenyl)pyridine-2,3-diamine

Systemtic Name: N2,N3-bis(2,4,6-trinitrophenyl)pyridine-2,3-diamine Openeye Name: N2,N3-bis(2,4,6-trinitrophenyl)pyridine-2,3-diamine CAS Name: N2,N3-bis(2,4,6-trinitrophenyl)pyridine-2,3-diamine IUPAC Name: 2-N,3-N-bis(2,4,6-trinitrophenyl)pyridine-2,3-diamine Traditional Name: picryl-[2-(2,4,6-trinitroanilino)-3-pyridyl]amine Formula: C17H9N9O12 MolecularWeight: 531.30646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H9N9O12/c27-21(28)8-4-11(23(31)32)15(12(5-8)24(33)34)19-10-2-1-3-18-17(10)20-16-13(25(35)36)6-9(22(29)30)7-14(16)26(37)38/h1-7,19H,(H,18,20)