5-[[2-(2-bromanyl-4-methyl-phenoxy)ethanoylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[2-(2-bromanyl-4-methyl-phenoxy)ethanoylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[[2-(2-bromo-4-methyl-phenoxy)acetyl]amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[2-(2-bromo-4-methylphenoxy)-1-oxoethyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[[2-(2-bromo-4-methylphenoxy)acetyl]amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[[2-(2-bromo-4-methyl-phenoxy)acetyl]amino]methyl]-2-methoxy-benzoic acid Formula: C18H18BrNO5 MolecularWeight: 408.24322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)O)Br

InChI

InChI=1S/C18H18BrNO5/c1-11-3-5-16(14(19)7-11)25-10-17(21)20-9-12-4-6-15(24-2)13(8-12)18(22)23/h3-8H,9-10H2,1-2H3,(H,20,21)(H,22,23)