4,4-diethyl-2-(2,4,6-trinitrophenyl)-1,2-dihydro-3,1-benzoxazine

Systemtic Name: 4,4-diethyl-2-(2,4,6-trinitrophenyl)-1,2-dihydro-3,1-benzoxazine Openeye Name: 4,4-diethyl-2-(2,4,6-trinitrophenyl)-1,2-dihydro-3,1-benzoxazine CAS Name: 4,4-diethyl-2-(2,4,6-trinitrophenyl)-1,2-dihydro-3,1-benzoxazine IUPAC Name: 4,4-diethyl-2-(2,4,6-trinitrophenyl)-1,2-dihydro-3,1-benzoxazine Traditional Name: 4,4-diethyl-2-picryl-1,2-dihydro-3,1-benzoxazine Formula: C18H18N4O7 MolecularWeight: 402.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC=CC=C2NC(O1)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])CC

Isomeric SMILES

CCC1(C2=CC=CC=C2NC(O1)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])CC

InChI

InChI=1S/C18H18N4O7/c1-3-18(4-2)12-7-5-6-8-13(12)19-17(29-18)16-14(21(25)26)9-11(20(23)24)10-15(16)22(27)28/h5-10,17,19H,3-4H2,1-2H3