6-(3-iodanyl-1-phenyl-propoxy)-1-benzothiophene-2-carbonitrile

Systemtic Name: 6-(3-iodanyl-1-phenyl-propoxy)-1-benzothiophene-2-carbonitrile Openeye Name: 6-(3-iodo-1-phenyl-propoxy)benzothiophene-2-carbonitrile CAS Name: 6-(3-iodo-1-phenylpropoxy)-1-benzothiophene-2-carbonitrile IUPAC Name: 6-(3-iodo-1-phenylpropoxy)-1-benzothiophene-2-carbonitrile Traditional Name: 6-(3-iodo-1-phenyl-propoxy)benzothiophene-2-carbonitrile Formula: C18H14INOS MolecularWeight: 419.27933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCI)OC2=CC3=C(C=C2)C=C(S3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CCI)OC2=CC3=C(C=C2)C=C(S3)C#N

InChI

InChI=1S/C18H14INOS/c19-9-8-17(13-4-2-1-3-5-13)21-15-7-6-14-10-16(12-20)22-18(14)11-15/h1-7,10-11,17H,8-9H2