N2,N5-bis(2,4,6-trinitrophenyl)pyridine-2,5-diamine

Systemtic Name: N2,N5-bis(2,4,6-trinitrophenyl)pyridine-2,5-diamine Openeye Name: N2,N5-bis(2,4,6-trinitrophenyl)pyridine-2,5-diamine CAS Name: N2,N5-bis(2,4,6-trinitrophenyl)pyridine-2,5-diamine IUPAC Name: 2-N,5-N-bis(2,4,6-trinitrophenyl)pyridine-2,5-diamine Traditional Name: picryl-[5-(2,4,6-trinitroanilino)-2-pyridyl]amine Formula: C17H9N9O12 MolecularWeight: 531.30646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1NC2=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(=NC=C1NC2=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)9-3-11(23(31)32)16(12(4-9)24(33)34)19-8-1-2-15(18-7-8)20-17-13(25(35)36)5-10(22(29)30)6-14(17)26(37)38/h1-7,19H,(H,18,20)