2-tert-butyl-5-methyl-5-(2-nitro-1-phenyl-prop-2-enyl)-1,3-dioxolan-4-one

Systemtic Name: 2-tert-butyl-5-methyl-5-(2-nitro-1-phenyl-prop-2-enyl)-1,3-dioxolan-4-one Openeye Name: 2-tert-butyl-5-methyl-5-(2-nitro-1-phenyl-allyl)-1,3-dioxolan-4-one CAS Name: 2-tert-butyl-5-methyl-5-(2-nitro-1-phenylprop-2-enyl)-1,3-dioxolan-4-one IUPAC Name: 2-tert-butyl-5-methyl-5-(2-nitro-1-phenylprop-2-enyl)-1,3-dioxolan-4-one Traditional Name: 2-tert-butyl-5-methyl-5-(2-nitro-1-phenyl-allyl)-1,3-dioxolan-4-one Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO5/c1-11(18(20)21)13(12-9-7-6-8-10-12)17(5)14(19)22-15(23-17)16(2,3)4/h6-10,13,15H,1H2,2-5H3