4-(phenylmethoxymethyl)-1H-isothiochromene-6-carbonitrile

Systemtic Name: 4-(phenylmethoxymethyl)-1H-isothiochromene-6-carbonitrile Openeye Name: 4-(benzyloxymethyl)-1H-isothiochromene-6-carbonitrile CAS Name: 4-(phenylmethoxymethyl)-1H-2-benzothiopyran-6-carbonitrile IUPAC Name: 4-(phenylmethoxymethyl)-1H-isothiochromene-6-carbonitrile Traditional Name: 4-(benzoxymethyl)-1H-isothiochromene-6-carbonitrile Formula: C18H15NOS MolecularWeight: 293.3828

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C#N)C(=CS1)COCC3=CC=CC=C3

Isomeric SMILES

C1C2=C(C=C(C=C2)C#N)C(=CS1)COCC3=CC=CC=C3

InChI

InChI=1S/C18H15NOS/c19-9-15-6-7-16-12-21-13-17(18(16)8-15)11-20-10-14-4-2-1-3-5-14/h1-8,13H,10-12H2