(6-nitro-1,3-benzodioxol-5-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate

Systemtic Name: (6-nitro-1,3-benzodioxol-5-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate Openeye Name: (6-nitro-1,3-benzodioxol-5-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate CAS Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid (6-nitro-1,3-benzodioxol-5-yl) ester IUPAC Name: (6-nitro-1,3-benzodioxol-5-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate Traditional Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylic acid (6-nitro-1,3-benzodioxol-5-yl) ester Formula: C17H19NO6 MolecularWeight: 333.33586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1C(C1(C)C)C(=O)OC2=CC3=C(C=C2[N+](=O)[O-])OCO3)C

Isomeric SMILES

CC(=CC1C(C1(C)C)C(=O)OC2=CC3=C(C=C2[N+](=O)[O-])OCO3)C

InChI

InChI=1S/C17H19NO6/c1-9(2)5-10-15(17(10,3)4)16(19)24-12-7-14-13(22-8-23-14)6-11(12)18(20)21/h5-7,10,15H,8H2,1-4H3