(3S,5R)-3-(6-chloranyl-4-oxidanylidene-chromen-3-yl)-2-phenyl-1,2-oxazolidine-5-carbonitrile

Systemtic Name: (3S,5R)-3-(6-chloranyl-4-oxidanylidene-chromen-3-yl)-2-phenyl-1,2-oxazolidine-5-carbonitrile Openeye Name: (3S,5R)-3-(6-chloro-4-oxo-chromen-3-yl)-2-phenyl-isoxazolidine-5-carbonitrile CAS Name: (3S,5R)-3-(6-chloro-4-oxo-1-benzopyran-3-yl)-2-phenyl-5-isoxazolidinecarbonitrile IUPAC Name: (3S,5R)-3-(6-chloro-4-oxochromen-3-yl)-2-phenyl-1,2-oxazolidine-5-carbonitrile Traditional Name: (3S,5R)-3-(6-chloro-4-keto-chromen-3-yl)-2-phenyl-isoxazolidine-5-carbonitrile Formula: C19H13ClN2O3 MolecularWeight: 352.77112

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON(C1C2=COC3=C(C2=O)C=C(C=C3)Cl)C4=CC=CC=C4)C#N

Isomeric SMILES

C1[C@@H](ON([C@@H]1C2=COC3=C(C2=O)C=C(C=C3)Cl)C4=CC=CC=C4)C#N

InChI

InChI=1S/C19H13ClN2O3/c20-12-6-7-18-15(8-12)19(23)16(11-24-18)17-9-14(10-21)25-22(17)13-4-2-1-3-5-13/h1-8,11,14,17H,9H2/t14-,17+/m1/s1