3-iodanyl-5-methoxy-4-phenacyloxy-benzenecarbonitrile

Systemtic Name: 3-iodanyl-5-methoxy-4-phenacyloxy-benzenecarbonitrile Openeye Name: 3-iodo-5-methoxy-4-phenacyloxy-benzonitrile CAS Name: 3-iodo-5-methoxy-4-phenacyloxybenzonitrile IUPAC Name: 3-iodo-5-methoxy-4-phenacyloxybenzonitrile Traditional Name: 3-iodo-5-methoxy-4-phenacyloxy-benzonitrile Formula: C16H12INO3 MolecularWeight: 393.17585

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C#N)I)OCC(=O)C2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)C#N)I)OCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H12INO3/c1-20-15-8-11(9-18)7-13(17)16(15)21-10-14(19)12-5-3-2-4-6-12/h2-8H,10H2,1H3