[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 3,4-dimethoxybenzoate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 3,4-dimethoxybenzoate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C17H15NO7 MolecularWeight: 345.3035

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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