methyl 2-[2-nitro-4-(2-nitropropyl)phenoxy]ethanoate

Systemtic Name: methyl 2-[2-nitro-4-(2-nitropropyl)phenoxy]ethanoate Openeye Name: methyl 2-[2-nitro-4-(2-nitropropyl)phenoxy]acetate CAS Name: 2-[2-nitro-4-(2-nitropropyl)phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-nitro-4-(2-nitropropyl)phenoxy]acetate Traditional Name: 2-[2-nitro-4-(2-nitropropyl)phenoxy]acetic acid methyl ester Formula: C12H14N2O7 MolecularWeight: 298.24876

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1)OCC(=O)OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(CC1=CC(=C(C=C1)OCC(=O)OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O7/c1-8(13(16)17)5-9-3-4-11(10(6-9)14(18)19)21-7-12(15)20-2/h3-4,6,8H,5,7H2,1-2H3