5-oxidanyl-3-phenyl-3,4-dihydro-1H-isochromene-1-carbonitrile

Systemtic Name: 5-oxidanyl-3-phenyl-3,4-dihydro-1H-isochromene-1-carbonitrile Openeye Name: 5-hydroxy-3-phenyl-isochromane-1-carbonitrile CAS Name: 5-hydroxy-3-phenyl-3,4-dihydro-1H-2-benzopyran-1-carbonitrile IUPAC Name: 5-hydroxy-3-phenyl-3,4-dihydro-1H-isochromene-1-carbonitrile Traditional Name: 5-hydroxy-3-phenyl-isochroman-1-carbonitrile Formula: C16H13NO2 MolecularWeight: 251.27992

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(C2=C1C(=CC=C2)O)C#N)C3=CC=CC=C3

Isomeric SMILES

C1C(OC(C2=C1C(=CC=C2)O)C#N)C3=CC=CC=C3

InChI

InChI=1S/C16H13NO2/c17-10-16-12-7-4-8-14(18)13(12)9-15(19-16)11-5-2-1-3-6-11/h1-8,15-16,18H,9H2