2,2-dimethyl-4-[[4-nitro-2-(2-phenylethynyl)cyclohexa-1,3-dien-1-yl]oxymethyl]-1,3-dioxolane

Systemtic Name: 2,2-dimethyl-4-[[4-nitro-2-(2-phenylethynyl)cyclohexa-1,3-dien-1-yl]oxymethyl]-1,3-dioxolane Openeye Name: 2,2-dimethyl-4-[[4-nitro-2-(2-phenylethynyl)cyclohexa-1,3-dien-1-yl]oxymethyl]-1,3-dioxolane CAS Name: 2,2-dimethyl-4-[[4-nitro-2-(2-phenylethynyl)-1-cyclohexa-1,3-dienyl]oxymethyl]-1,3-dioxolane IUPAC Name: 2,2-dimethyl-4-[[4-nitro-2-(2-phenylethynyl)cyclohexa-1,3-dien-1-yl]oxymethyl]-1,3-dioxolane Traditional Name: 2,2-dimethyl-4-[[4-nitro-2-(2-phenylethynyl)cyclohexa-1,3-dien-1-yl]oxymethyl]-1,3-dioxolane Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)COC2=C(C=C(CC2)[N+](=O)[O-])C#CC3=CC=CC=C3)C

Isomeric SMILES

CC1(OCC(O1)COC2=C(C=C(CC2)[N+](=O)[O-])C#CC3=CC=CC=C3)C

InChI

InChI=1S/C20H21NO5/c1-20(2)25-14-18(26-20)13-24-19-11-10-17(21(22)23)12-16(19)9-8-15-6-4-3-5-7-15/h3-7,12,18H,10-11,13-14H2,1-2H3