2-(3,5-dinitropyridin-2-yl)oxy-3,5,7-trimethyl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-(3,5-dinitropyridin-2-yl)oxy-3,5,7-trimethyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[(3,5-dinitro-2-pyridyl)oxy]-3,5,7-trimethyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-[(3,5-dinitro-2-pyridinyl)oxy]-3,5,7-trimethyl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-(3,5-dinitropyridin-2-yl)oxy-3,5,7-trimethylcyclohepta-2,4,6-trien-1-one Traditional Name: 2-[(3,5-dinitro-2-pyridyl)oxy]-3,5,7-trimethyl-cyclohepta-2,4,6-trien-1-one Formula: C15H13N3O6 MolecularWeight: 331.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)C(=C1)C)OC2=C(C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=O)C(=C1)C)OC2=C(C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C15H13N3O6/c1-8-4-9(2)13(19)14(10(3)5-8)24-15-12(18(22)23)6-11(7-16-15)17(20)21/h4-7H,1-3H3