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

Systemtic Name: ethyl 4-(2-methoxy-2-oxidanylidene-ethyl)-3-nitro-benzoate Openeye Name: ethyl 4-(2-methoxy-2-oxo-ethyl)-3-nitro-benzoate CAS Name: 4-(2-methoxy-2-oxoethyl)-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-(2-methoxy-2-oxoethyl)-3-nitrobenzoate Traditional Name: 4-(2-keto-2-methoxy-ethyl)-3-nitro-benzoic acid ethyl ester Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO6/c1-3-19-12(15)9-5-4-8(7-11(14)18-2)10(6-9)13(16)17/h4-6H,3,7H2,1-2H3