6-(3,5-dinitrophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-(3,5-dinitrophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Openeye Name: 6-(3,5-dinitrophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one CAS Name: 6-(3,5-dinitrophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one IUPAC Name: 6-(3,5-dinitrophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Traditional Name: 6-(3,5-dinitrophenyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Formula: C16H13N3O6 MolecularWeight: 343.29092

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])NC(=O)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])NC(=O)O1)C

InChI

InChI=1S/C16H13N3O6/c1-16(2)13-7-9(3-4-14(13)17-15(20)25-16)10-5-11(18(21)22)8-12(6-10)19(23)24/h3-8H,1-2H3,(H,17,20)