[4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 4-methoxy-3-nitro-benzoate

Systemtic Name: [4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 4-methoxy-3-nitro-benzoate Openeye Name: [4-(2-methoxy-2-oxo-ethyl)phenyl] 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid [4-(2-methoxy-2-oxoethyl)phenyl] ester IUPAC Name: [4-(2-methoxy-2-oxoethyl)phenyl] 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid [4-(2-keto-2-methoxy-ethyl)phenyl] ester Formula: C17H15NO7 MolecularWeight: 345.3035

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO7/c1-23-15-8-5-12(10-14(15)18(21)22)17(20)25-13-6-3-11(4-7-13)9-16(19)24-2/h3-8,10H,9H2,1-2H3