diethyl 2-methyl-2-nitro-propanedioate; fluoranylbenzene

Systemtic Name: diethyl 2-methyl-2-nitro-propanedioate; fluoranylbenzene Openeye Name: diethyl 2-methyl-2-nitro-propanedioate; fluorobenzene CAS Name: fluorobenzene; 2-methyl-2-nitropropanedioic acid diethyl ester IUPAC Name: diethyl 2-methyl-2-nitropropanedioate; fluorobenzene Traditional Name: fluorobenzene; 2-methyl-2-nitro-malonic acid diethyl ester Formula: C14H18FNO6 MolecularWeight: 315.294223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C(=O)OCC)[N+](=O)[O-].C1=CC=C(C=C1)F

Isomeric SMILES

CCOC(=O)C(C)(C(=O)OCC)[N+](=O)[O-].C1=CC=C(C=C1)F

InChI

InChI=1S/C8H13NO6.C6H5F/c1-4-14-6(10)8(3,9(12)13)7(11)15-5-2;7-6-4-2-1-3-5-6/h4-5H2,1-3H3;1-5H