4-[[[(2S)-2-(3-bromanylphenoxy)propanoyl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[(2S)-2-(3-bromanylphenoxy)propanoyl]amino]methyl]benzoic acid Openeye Name: 4-[[[(2S)-2-(3-bromophenoxy)propanoyl]amino]methyl]benzoic acid CAS Name: 4-[[[(2S)-2-(3-bromophenoxy)-1-oxopropyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[(2S)-2-(3-bromophenoxy)propanoyl]amino]methyl]benzoic acid Traditional Name: 4-[[[(2S)-2-(3-bromophenoxy)propanoyl]amino]methyl]benzoic acid Formula: C17H16BrNO4 MolecularWeight: 378.21724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)C(=O)O)OC2=CC(=CC=C2)Br

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)C(=O)O)OC2=CC(=CC=C2)Br

InChI

InChI=1S/C17H16BrNO4/c1-11(23-15-4-2-3-14(18)9-15)16(20)19-10-12-5-7-13(8-6-12)17(21)22/h2-9,11H,10H2,1H3,(H,19,20)(H,21,22)/t11-/m0/s1