methyl 5-bromanyl-2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)oxy]pentanoate

Systemtic Name: methyl 5-bromanyl-2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)oxy]pentanoate Openeye Name: methyl 5-bromo-2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)oxy]pentanoate CAS Name: 5-bromo-2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)oxy]pentanoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)oxy]pentanoate Traditional Name: 5-bromo-2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)oxy]valeric acid methyl ester Formula: C14H16BrNO7 MolecularWeight: 390.18334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCBr)OC1=CC2=C(C=C1[N+](=O)[O-])OCCO2

Isomeric SMILES

COC(=O)C(CCCBr)OC1=CC2=C(C=C1[N+](=O)[O-])OCCO2

InChI

InChI=1S/C14H16BrNO7/c1-20-14(17)10(3-2-4-15)23-11-8-13-12(21-5-6-22-13)7-9(11)16(18)19/h7-8,10H,2-6H2,1H3