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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)OC1=C(C=C(C=C1Br)C(=O)O)OC

Isomeric SMILES

CC(C)NC(=O)C(C)OC1=C(C=C(C=C1Br)C(=O)O)OC

InChI

InChI=1S/C14H18BrNO5/c1-7(2)16-13(17)8(3)21-12-10(15)5-9(14(18)19)6-11(12)20-4/h5-8H,1-4H3,(H,16,17)(H,18,19)