2-[[2,3-bis(bromanyl)phenyl]-(3-ethoxy-3-oxidanylidene-propyl)amino]ethanoic acid

Systemtic Name: 2-[[2,3-bis(bromanyl)phenyl]-(3-ethoxy-3-oxidanylidene-propyl)amino]ethanoic acid Openeye Name: 2-(2,3-dibromo-N-(3-ethoxy-3-oxo-propyl)anilino)acetic acid CAS Name: 2-(2,3-dibromo-N-(3-ethoxy-3-oxopropyl)anilino)acetic acid IUPAC Name: 2-(2,3-dibromo-N-(3-ethoxy-3-oxopropyl)anilino)acetic acid Traditional Name: 2-(2,3-dibromo-N-(3-ethoxy-3-keto-propyl)anilino)acetic acid Formula: C13H15Br2NO4 MolecularWeight: 409.0705

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC(=O)O)C1=C(C(=CC=C1)Br)Br

Isomeric SMILES

CCOC(=O)CCN(CC(=O)O)C1=C(C(=CC=C1)Br)Br

InChI

InChI=1S/C13H15Br2NO4/c1-2-20-12(19)6-7-16(8-11(17)18)10-5-3-4-9(14)13(10)15/h3-5H,2,6-8H2,1H3,(H,17,18)