4-(4-methanoyl-2-methoxy-5-nitro-phenoxy)butanenitrile

Systemtic Name: 4-(4-methanoyl-2-methoxy-5-nitro-phenoxy)butanenitrile Openeye Name: 4-(4-formyl-2-methoxy-5-nitro-phenoxy)butanenitrile CAS Name: 4-(4-formyl-2-methoxy-5-nitrophenoxy)butanenitrile IUPAC Name: 4-(4-formyl-2-methoxy-5-nitrophenoxy)butanenitrile Traditional Name: 4-(4-formyl-2-methoxy-5-nitro-phenoxy)butyronitrile Formula: C12H12N2O5 MolecularWeight: 264.23408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O5/c1-18-11-6-9(8-15)10(14(16)17)7-12(11)19-5-3-2-4-13/h6-8H,2-3,5H2,1H3