(4-iodophenyl) 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: (4-iodophenyl) 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: (4-iodophenyl) 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid (4-iodophenyl) ester IUPAC Name: (4-iodophenyl) 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid (4-iodophenyl) ester Formula: C16H14INO6 MolecularWeight: 443.18993

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OC2=CC=C(C=C2)I)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OC2=CC=C(C=C2)I)[N+](=O)[O-])OC

InChI

InChI=1S/C16H14INO6/c1-3-23-15-8-12(13(18(20)21)9-14(15)22-2)16(19)24-11-6-4-10(17)5-7-11/h4-9H,3H2,1-2H3