3,5-dinitro-N-(3,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)benzamide

Systemtic Name: 3,5-dinitro-N-(3,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)benzamide Openeye Name: 3,5-dinitro-N-(3,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl)benzamide CAS Name: 3,5-dinitro-N-(3,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl)benzamide IUPAC Name: 3,5-dinitro-N-(3,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)benzamide Traditional Name: 3,5-dinitro-N-(3,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl)benzamide Formula: C18H19N3O6 MolecularWeight: 373.35996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=C1C(CC(C2)(C)C)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=COC2=C1C(CC(C2)(C)C)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O6/c1-10-9-27-15-8-18(2,3)7-14(16(10)15)19-17(22)11-4-12(20(23)24)6-13(5-11)21(25)26/h4-6,9,14H,7-8H2,1-3H3,(H,19,22)