(2R)-4-(4-methoxy-2-nitro-phenoxy)-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: (2R)-4-(4-methoxy-2-nitro-phenoxy)-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: (2R)-4-(4-methoxy-2-nitro-phenoxy)-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: (2R)-4-(4-methoxy-2-nitrophenoxy)-2-(4-methyl-2-thiazolyl)-3-oxobutanenitrile IUPAC Name: (2R)-4-(4-methoxy-2-nitrophenoxy)-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobutanenitrile Traditional Name: (2R)-3-keto-4-(4-methoxy-2-nitro-phenoxy)-2-(4-methylthiazol-2-yl)butyronitrile Formula: C15H13N3O5S MolecularWeight: 347.34582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)COC2=C(C=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)[C@H](C#N)C(=O)COC2=C(C=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O5S/c1-9-8-24-15(17-9)11(6-16)13(19)7-23-14-4-3-10(22-2)5-12(14)18(20)21/h3-5,8,11H,7H2,1-2H3/t11-/m1/s1