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

Systemtic Name: ethyl 3-(7-chloranyl-1-benzofuran-2-yl)-4-nitro-butanoate Openeye Name: ethyl 3-(7-chlorobenzofuran-2-yl)-4-nitro-butanoate CAS Name: 3-(7-chloro-2-benzofuranyl)-4-nitrobutanoic acid ethyl ester IUPAC Name: ethyl 3-(7-chloro-1-benzofuran-2-yl)-4-nitrobutanoate Traditional Name: 3-(7-chlorobenzofuran-2-yl)-4-nitro-butyric acid ethyl ester Formula: C14H14ClNO5 MolecularWeight: 311.71766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14ClNO5/c1-2-20-13(17)7-10(8-16(18)19)12-6-9-4-3-5-11(15)14(9)21-12/h3-6,10H,2,7-8H2,1H3