2-nitrooxyethyl (E)-5-[2,3-bis(chloranyl)phenyl]-3-oxidanylidene-pent-4-enoate

Systemtic Name: 2-nitrooxyethyl (E)-5-[2,3-bis(chloranyl)phenyl]-3-oxidanylidene-pent-4-enoate Openeye Name: 2-nitrooxyethyl (E)-5-(2,3-dichlorophenyl)-3-oxo-pent-4-enoate CAS Name: (E)-5-(2,3-dichlorophenyl)-3-oxo-4-pentenoic acid 2-nitrooxyethyl ester IUPAC Name: 2-nitrooxyethyl (E)-5-(2,3-dichlorophenyl)-3-oxopent-4-enoate Traditional Name: (E)-5-(2,3-dichlorophenyl)-3-keto-pent-4-enoic acid 2-nitrooxyethyl ester Formula: C13H11Cl2NO6 MolecularWeight: 348.13554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)Cl)C=CC(=O)CC(=O)OCCO[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)Cl)/C=C/C(=O)CC(=O)OCCO[N+](=O)[O-]

InChI

InChI=1S/C13H11Cl2NO6/c14-11-3-1-2-9(13(11)15)4-5-10(17)8-12(18)21-6-7-22-16(19)20/h1-5H,6-8H2/b5-4+