(2-methoxy-5-nitro-phenyl) 3-iodanylbenzoate

Systemtic Name: (2-methoxy-5-nitro-phenyl) 3-iodanylbenzoate Openeye Name: (2-methoxy-5-nitro-phenyl) 3-iodobenzoate CAS Name: 3-iodobenzoic acid (2-methoxy-5-nitrophenyl) ester IUPAC Name: (2-methoxy-5-nitrophenyl) 3-iodobenzoate Traditional Name: 3-iodobenzoic acid (2-methoxy-5-nitro-phenyl) ester Formula: C14H10INO5 MolecularWeight: 399.13737

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10INO5/c1-20-12-6-5-11(16(18)19)8-13(12)21-14(17)9-3-2-4-10(15)7-9/h2-8H,1H3