2-[2-azanyl-3-(4-bromophenyl)carbonyl-5-fluoranyl-phenyl]propanoic acid

Systemtic Name: 2-[2-azanyl-3-(4-bromophenyl)carbonyl-5-fluoranyl-phenyl]propanoic acid Openeye Name: 2-[2-amino-3-(4-bromobenzoyl)-5-fluoro-phenyl]propanoic acid CAS Name: 2-[2-amino-3-[(4-bromophenyl)-oxomethyl]-5-fluorophenyl]propanoic acid IUPAC Name: 2-[2-amino-3-(4-bromobenzoyl)-5-fluorophenyl]propanoic acid Traditional Name: 2-[2-amino-3-(4-bromobenzoyl)-5-fluoro-phenyl]propionic acid Formula: C16H13BrFNO3 MolecularWeight: 366.181723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=CC(=C1)F)C(=O)C2=CC=C(C=C2)Br)N)C(=O)O

Isomeric SMILES

CC(C1=C(C(=CC(=C1)F)C(=O)C2=CC=C(C=C2)Br)N)C(=O)O

InChI

InChI=1S/C16H13BrFNO3/c1-8(16(21)22)12-6-11(18)7-13(14(12)19)15(20)9-2-4-10(17)5-3-9/h2-8H,19H2,1H3,(H,21,22)