2-[(4-acetyloxy-3-methoxy-phenyl)carbonylamino]-5-bromanyl-benzoic acid

Systemtic Name: 2-[(4-acetyloxy-3-methoxy-phenyl)carbonylamino]-5-bromanyl-benzoic acid Openeye Name: 2-[(4-acetoxy-3-methoxy-benzoyl)amino]-5-bromo-benzoic acid CAS Name: 2-[[(4-acetyloxy-3-methoxyphenyl)-oxomethyl]amino]-5-bromobenzoic acid IUPAC Name: 2-[(4-acetyloxy-3-methoxybenzoyl)amino]-5-bromobenzoic acid Traditional Name: 2-[(4-acetoxy-3-methoxy-benzoyl)amino]-5-bromo-benzoic acid Formula: C17H14BrNO6 MolecularWeight: 408.20016

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)Br)C(=O)O)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)Br)C(=O)O)OC

InChI

InChI=1S/C17H14BrNO6/c1-9(20)25-14-6-3-10(7-15(14)24-2)16(21)19-13-5-4-11(18)8-12(13)17(22)23/h3-8H,1-2H3,(H,19,21)(H,22,23)