3-bromanyl-5-ethoxy-4-[1-(ethylamino)-1-oxidanylidene-propan-2-yl]oxy-benzoic acid

Systemtic Name: 3-bromanyl-5-ethoxy-4-[1-(ethylamino)-1-oxidanylidene-propan-2-yl]oxy-benzoic acid Openeye Name: 3-bromo-5-ethoxy-4-[2-(ethylamino)-1-methyl-2-oxo-ethoxy]benzoic acid CAS Name: 3-bromo-5-ethoxy-4-[1-(ethylamino)-1-oxopropan-2-yl]oxybenzoic acid IUPAC Name: 3-bromo-5-ethoxy-4-[1-(ethylamino)-1-oxopropan-2-yl]oxybenzoic acid Traditional Name: 3-bromo-5-ethoxy-4-[2-(ethylamino)-2-keto-1-methyl-ethoxy]benzoic acid Formula: C14H18BrNO5 MolecularWeight: 360.20042

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC1=C(C=C(C=C1Br)C(=O)O)OCC

Isomeric SMILES

CCNC(=O)C(C)OC1=C(C=C(C=C1Br)C(=O)O)OCC

InChI

InChI=1S/C14H18BrNO5/c1-4-16-13(17)8(3)21-12-10(15)6-9(14(18)19)7-11(12)20-5-2/h6-8H,4-5H2,1-3H3,(H,16,17)(H,18,19)