ethyl 4-(2-chloranyl-3-methanoyl-4-nitro-phenoxy)butanoate

Systemtic Name: ethyl 4-(2-chloranyl-3-methanoyl-4-nitro-phenoxy)butanoate Openeye Name: ethyl 4-(2-chloro-3-formyl-4-nitro-phenoxy)butanoate CAS Name: 4-(2-chloro-3-formyl-4-nitrophenoxy)butanoic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-3-formyl-4-nitrophenoxy)butanoate Traditional Name: 4-(2-chloro-3-formyl-4-nitro-phenoxy)butyric acid ethyl ester Formula: C13H14ClNO6 MolecularWeight: 315.70636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=C(C(=C(C=C1)[N+](=O)[O-])C=O)Cl

Isomeric SMILES

CCOC(=O)CCCOC1=C(C(=C(C=C1)[N+](=O)[O-])C=O)Cl

InChI

InChI=1S/C13H14ClNO6/c1-2-20-12(17)4-3-7-21-11-6-5-10(15(18)19)9(8-16)13(11)14/h5-6,8H,2-4,7H2,1H3