2-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamoyl]benzoic acid

Systemtic Name: 2-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamoyl]benzoic acid Openeye Name: 2-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]carbamoyl]benzoic acid CAS Name: 2-[[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]hydrazo]-oxomethyl]benzoic acid IUPAC Name: 2-[[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]carbamoyl]benzoic acid Traditional Name: 2-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]carbamoyl]benzoic acid Formula: C18H17BrN2O5 MolecularWeight: 421.24198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NNC(=O)C2=CC=CC=C2C(=O)O)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NNC(=O)C2=CC=CC=C2C(=O)O)Br

InChI

InChI=1S/C18H17BrN2O5/c1-2-11-7-8-15(14(19)9-11)26-10-16(22)20-21-17(23)12-5-3-4-6-13(12)18(24)25/h3-9H,2,10H2,1H3,(H,20,22)(H,21,23)(H,24,25)