methyl 2-(2-ethoxy-2-oxidanylidene-ethyl)-6-nitro-benzoate

Systemtic Name: methyl 2-(2-ethoxy-2-oxidanylidene-ethyl)-6-nitro-benzoate Openeye Name: methyl 2-(2-ethoxy-2-oxo-ethyl)-6-nitro-benzoate CAS Name: 2-(2-ethoxy-2-oxoethyl)-6-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(2-ethoxy-2-oxoethyl)-6-nitrobenzoate Traditional Name: 2-(2-ethoxy-2-keto-ethyl)-6-nitro-benzoic acid methyl ester Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCOC(=O)CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC

InChI

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