4-[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]-3-methyl-benzoic acid Openeye Name: 4-[[2-(2,4-dibromophenoxy)acetyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[2-(2,4-dibromophenoxy)-1-oxoethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[2-(2,4-dibromophenoxy)acetyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[2-(2,4-dibromophenoxy)acetyl]amino]-3-methyl-benzoic acid Formula: C16H13Br2NO4 MolecularWeight: 443.08672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)COC2=C(C=C(C=C2)Br)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)COC2=C(C=C(C=C2)Br)Br

InChI

InChI=1S/C16H13Br2NO4/c1-9-6-10(16(21)22)2-4-13(9)19-15(20)8-23-14-5-3-11(17)7-12(14)18/h2-7H,8H2,1H3,(H,19,20)(H,21,22)