[4-(cyanomethyl)phenyl] 3-iodanylbenzoate

Systemtic Name: [4-(cyanomethyl)phenyl] 3-iodanylbenzoate Openeye Name: [4-(cyanomethyl)phenyl] 3-iodobenzoate CAS Name: 3-iodobenzoic acid [4-(cyanomethyl)phenyl] ester IUPAC Name: [4-(cyanomethyl)phenyl] 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [4-(cyanomethyl)phenyl] ester Formula: C15H10INO2 MolecularWeight: 363.14987

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C(=O)OC2=CC=C(C=C2)CC#N

Isomeric SMILES

C1=CC(=CC(=C1)I)C(=O)OC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C15H10INO2/c16-13-3-1-2-12(10-13)15(18)19-14-6-4-11(5-7-14)8-9-17/h1-7,10H,8H2