2-[(5-bromanyl-2-iodanyl-phenyl)carbonyl-(cyclopropylmethyl)amino]ethanoic acid

Systemtic Name: 2-[(5-bromanyl-2-iodanyl-phenyl)carbonyl-(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[(5-bromo-2-iodo-benzoyl)-(cyclopropylmethyl)amino]acetic acid CAS Name: 2-[[(5-bromo-2-iodophenyl)-oxomethyl]-(cyclopropylmethyl)amino]acetic acid IUPAC Name: 2-[(5-bromo-2-iodobenzoyl)-(cyclopropylmethyl)amino]acetic acid Traditional Name: 2-[(5-bromo-2-iodo-benzoyl)-(cyclopropylmethyl)amino]acetic acid Formula: C13H13BrINO3 MolecularWeight: 438.05569

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC(=O)O)C(=O)C2=C(C=CC(=C2)Br)I

Isomeric SMILES

C1CC1CN(CC(=O)O)C(=O)C2=C(C=CC(=C2)Br)I

InChI

InChI=1S/C13H13BrINO3/c14-9-3-4-11(15)10(5-9)13(19)16(7-12(17)18)6-8-1-2-8/h3-5,8H,1-2,6-7H2,(H,17,18)