methyl 4-(4-azanyl-3-iodanyl-phenyl)benzoate

Systemtic Name: methyl 4-(4-azanyl-3-iodanyl-phenyl)benzoate Openeye Name: methyl 4-(4-amino-3-iodo-phenyl)benzoate CAS Name: 4-(4-amino-3-iodophenyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-amino-3-iodophenyl)benzoate Traditional Name: 4-(4-amino-3-iodo-phenyl)benzoic acid methyl ester Formula: C14H12INO2 MolecularWeight: 353.15505

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)N)I

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)N)I

InChI

InChI=1S/C14H12INO2/c1-18-14(17)10-4-2-9(3-5-10)11-6-7-13(16)12(15)8-11/h2-8H,16H2,1H3