4-[(2R,3R)-3-oxidanyl-4-oxidanylidene-2,3-dihydrochromen-2-yl]benzenecarbonitrile

Systemtic Name: 4-[(2R,3R)-3-oxidanyl-4-oxidanylidene-2,3-dihydrochromen-2-yl]benzenecarbonitrile Openeye Name: 4-[(2R,3R)-3-hydroxy-4-oxo-chroman-2-yl]benzonitrile CAS Name: 4-[(2R,3R)-3-hydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl]benzonitrile IUPAC Name: 4-[(2R,3R)-3-hydroxy-4-oxo-2,3-dihydrochromen-2-yl]benzonitrile Traditional Name: 4-[(2R,3R)-3-hydroxy-4-keto-chroman-2-yl]benzonitrile Formula: C16H11NO3 MolecularWeight: 265.26344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(C(O2)C3=CC=C(C=C3)C#N)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)[C@@H]([C@H](O2)C3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C16H11NO3/c17-9-10-5-7-11(8-6-10)16-15(19)14(18)12-3-1-2-4-13(12)20-16/h1-8,15-16,19H/t15-,16+/m0/s1