(5-nitro-2,3-dihydro-1-benzofuran-3-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate

Systemtic Name: (5-nitro-2,3-dihydro-1-benzofuran-3-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate Openeye Name: (5-nitro-2,3-dihydrobenzofuran-3-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate CAS Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid (5-nitro-2,3-dihydrobenzofuran-3-yl) ester IUPAC Name: (5-nitro-2,3-dihydro-1-benzofuran-3-yl) 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate Traditional Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylic acid (5-nitrocoumaran-3-yl) ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1C(C1(C)C)C(=O)OC2COC3=C2C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC(=CC1C(C1(C)C)C(=O)OC2COC3=C2C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H21NO5/c1-10(2)7-13-16(18(13,3)4)17(20)24-15-9-23-14-6-5-11(19(21)22)8-12(14)15/h5-8,13,15-16H,9H2,1-4H3