1,3-bis[2-(dimethylamino)-3,5-dinitro-phenyl]urea

Systemtic Name: 1,3-bis[2-(dimethylamino)-3,5-dinitro-phenyl]urea Openeye Name: 1,3-bis[2-(dimethylamino)-3,5-dinitro-phenyl]urea CAS Name: 1,3-bis[2-(dimethylamino)-3,5-dinitrophenyl]urea IUPAC Name: 1,3-bis[2-(dimethylamino)-3,5-dinitrophenyl]urea Traditional Name: 1,3-bis[2-(dimethylamino)-3,5-dinitro-phenyl]urea Formula: C17H18N8O9 MolecularWeight: 478.37302

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1NC(=O)NC2=CC(=CC(=C2N(C)C)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1NC(=O)NC2=CC(=CC(=C2N(C)C)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H18N8O9/c1-20(2)15-11(5-9(22(27)28)7-13(15)24(31)32)18-17(26)19-12-6-10(23(29)30)8-14(25(33)34)16(12)21(3)4/h5-8H,1-4H3,(H2,18,19,26)