methyl 2-azanyl-5-iodanyl-4-propan-2-yl-benzoate

Systemtic Name: methyl 2-azanyl-5-iodanyl-4-propan-2-yl-benzoate Openeye Name: methyl 2-amino-5-iodo-4-isopropyl-benzoate CAS Name: 2-amino-5-iodo-4-propan-2-ylbenzoic acid methyl ester IUPAC Name: methyl 2-amino-5-iodo-4-propan-2-ylbenzoate Traditional Name: 2-amino-5-iodo-4-isopropyl-benzoic acid methyl ester Formula: C11H14INO2 MolecularWeight: 319.13883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C(=C1)N)C(=O)OC)I

Isomeric SMILES

CC(C)C1=C(C=C(C(=C1)N)C(=O)OC)I

InChI

InChI=1S/C11H14INO2/c1-6(2)7-5-10(13)8(4-9(7)12)11(14)15-3/h4-6H,13H2,1-3H3