2-[3-(4-bromanylphenoxy)propylamino]benzoic acid

Systemtic Name: 2-[3-(4-bromanylphenoxy)propylamino]benzoic acid Openeye Name: 2-[3-(4-bromophenoxy)propylamino]benzoic acid CAS Name: 2-[3-(4-bromophenoxy)propylamino]benzoic acid IUPAC Name: 2-[3-(4-bromophenoxy)propylamino]benzoic acid Traditional Name: 2-[3-(4-bromophenoxy)propylamino]benzoic acid Formula: C16H16BrNO3 MolecularWeight: 350.20714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NCCCOC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NCCCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H16BrNO3/c17-12-6-8-13(9-7-12)21-11-3-10-18-15-5-2-1-4-14(15)16(19)20/h1-2,4-9,18H,3,10-11H2,(H,19,20)