3-bromanyl-4-[2-(diethylamino)-2-oxidanylidene-ethoxy]-5-methoxy-benzoic acid

Systemtic Name: 3-bromanyl-4-[2-(diethylamino)-2-oxidanylidene-ethoxy]-5-methoxy-benzoic acid Openeye Name: 3-bromo-4-[2-(diethylamino)-2-oxo-ethoxy]-5-methoxy-benzoic acid CAS Name: 3-bromo-4-[2-(diethylamino)-2-oxoethoxy]-5-methoxybenzoic acid IUPAC Name: 3-bromo-4-[2-(diethylamino)-2-oxoethoxy]-5-methoxybenzoic acid Traditional Name: 3-bromo-4-[2-(diethylamino)-2-keto-ethoxy]-5-methoxy-benzoic acid Formula: C14H18BrNO5 MolecularWeight: 360.20042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC1=C(C=C(C=C1Br)C(=O)O)OC

Isomeric SMILES

CCN(CC)C(=O)COC1=C(C=C(C=C1Br)C(=O)O)OC

InChI

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