ethyl 3-(7-methyl-1-benzofuran-2-yl)-4-nitro-butanoate

Systemtic Name: ethyl 3-(7-methyl-1-benzofuran-2-yl)-4-nitro-butanoate Openeye Name: ethyl 3-(7-methylbenzofuran-2-yl)-4-nitro-butanoate CAS Name: 3-(7-methyl-2-benzofuranyl)-4-nitrobutanoic acid ethyl ester IUPAC Name: ethyl 3-(7-methyl-1-benzofuran-2-yl)-4-nitrobutanoate Traditional Name: 3-(7-methylbenzofuran-2-yl)-4-nitro-butyric acid ethyl ester Formula: C15H17NO5 MolecularWeight: 291.29918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C[N+](=O)[O-])C1=CC2=C(O1)C(=CC=C2)C

Isomeric SMILES

CCOC(=O)CC(C[N+](=O)[O-])C1=CC2=C(O1)C(=CC=C2)C

InChI

InChI=1S/C15H17NO5/c1-3-20-14(17)8-12(9-16(18)19)13-7-11-6-4-5-10(2)15(11)21-13/h4-7,12H,3,8-9H2,1-2H3