2-cyanoethyl 2-(2,4-dinitrophenyl)sulfinylethanoate

Systemtic Name: 2-cyanoethyl 2-(2,4-dinitrophenyl)sulfinylethanoate Openeye Name: 2-cyanoethyl 2-(2,4-dinitrophenyl)sulfinylacetate CAS Name: 2-(2,4-dinitrophenyl)sulfinylacetic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 2-(2,4-dinitrophenyl)sulfinylacetate Traditional Name: 2-(2,4-dinitrophenyl)sulfinylacetic acid 2-cyanoethyl ester Formula: C11H9N3O7S MolecularWeight: 327.27006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)CC(=O)OCCC#N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)CC(=O)OCCC#N

InChI

InChI=1S/C11H9N3O7S/c12-4-1-5-21-11(15)7-22(20)10-3-2-8(13(16)17)6-9(10)14(18)19/h2-3,6H,1,5,7H2