ethyl 4-(2-chloranyl-3-methoxy-3-oxidanylidene-propyl)-3-nitro-benzoate

Systemtic Name: ethyl 4-(2-chloranyl-3-methoxy-3-oxidanylidene-propyl)-3-nitro-benzoate Openeye Name: ethyl 4-(2-chloro-3-methoxy-3-oxo-propyl)-3-nitro-benzoate CAS Name: 4-(2-chloro-3-methoxy-3-oxopropyl)-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-3-methoxy-3-oxopropyl)-3-nitrobenzoate Traditional Name: 4-(2-chloro-3-keto-3-methoxy-propyl)-3-nitro-benzoic acid ethyl ester Formula: C13H14ClNO6 MolecularWeight: 315.70636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14ClNO6/c1-3-21-12(16)9-5-4-8(11(7-9)15(18)19)6-10(14)13(17)20-2/h4-5,7,10H,3,6H2,1-2H3