N3,N5-bis(2,4,6-trinitrophenyl)pyridine-3,5-diamine

Systemtic Name: N3,N5-bis(2,4,6-trinitrophenyl)pyridine-3,5-diamine Openeye Name: N3,N5-bis(2,4,6-trinitrophenyl)pyridine-3,5-diamine CAS Name: N3,N5-bis(2,4,6-trinitrophenyl)pyridine-3,5-diamine IUPAC Name: 3-N,5-N-bis(2,4,6-trinitrophenyl)pyridine-3,5-diamine Traditional Name: picryl-[5-(2,4,6-trinitroanilino)-3-pyridyl]amine Formula: C17H9N9O12 MolecularWeight: 531.30646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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