(3S,4R)-2,2-dimethyl-3-oxidanyl-4-(2-oxidanylideneazetidin-1-yl)-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: (3S,4R)-2,2-dimethyl-3-oxidanyl-4-(2-oxidanylideneazetidin-1-yl)-3,4-dihydrochromene-6-carbonitrile Openeye Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-(2-oxoazetidin-1-yl)chromane-6-carbonitrile CAS Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-(2-oxo-1-azetidinyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-(2-oxoazetidin-1-yl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: (3S,4R)-3-hydroxy-4-(2-ketoazetidin-1-yl)-2,2-dimethyl-chroman-6-carbonitrile Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CCC3=O)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)C#N)N3CCC3=O)O)C

InChI

InChI=1S/C15H16N2O3/c1-15(2)14(19)13(17-6-5-12(17)18)10-7-9(8-16)3-4-11(10)20-15/h3-4,7,13-14,19H,5-6H2,1-2H3/t13-,14+/m1/s1