(4-methanoyl-2,6-dimethoxy-phenyl) 3-nitrobenzoate

Systemtic Name: (4-methanoyl-2,6-dimethoxy-phenyl) 3-nitrobenzoate Openeye Name: (4-formyl-2,6-dimethoxy-phenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (4-formyl-2,6-dimethoxyphenyl) ester IUPAC Name: (4-formyl-2,6-dimethoxyphenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (4-formyl-2,6-dimethoxy-phenyl) ester Formula: C16H13NO7 MolecularWeight: 331.27692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC)C=O

Isomeric SMILES

COC1=CC(=CC(=C1OC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC)C=O

InChI

InChI=1S/C16H13NO7/c1-22-13-6-10(9-18)7-14(23-2)15(13)24-16(19)11-4-3-5-12(8-11)17(20)21/h3-9H,1-2H3