2-ethanimidoyl-4-(2-methoxy-5-nitro-phenoxy)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-ethanimidoyl-4-(2-methoxy-5-nitro-phenoxy)-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-(2-methoxy-5-nitro-phenoxy)-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-(2-methoxy-5-nitrophenoxy)-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-(2-methoxy-5-nitrophenoxy)-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-(2-methoxy-5-nitro-phenoxy)butyronitrile Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC1=C(C=CC(=C1)[N+](=O)[O-])OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC1=C(C=CC(=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C13H13N3O5/c1-8(15)10(6-14)11(17)7-21-13-5-9(16(18)19)3-4-12(13)20-2/h3-5,10,15H,7H2,1-2H3