5-bromanyl-2-[3-(4-chloranylphenoxy)propylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[3-(4-chloranylphenoxy)propylamino]benzoic acid Openeye Name: 5-bromo-2-[3-(4-chlorophenoxy)propylamino]benzoic acid CAS Name: 5-bromo-2-[3-(4-chlorophenoxy)propylamino]benzoic acid IUPAC Name: 5-bromo-2-[3-(4-chlorophenoxy)propylamino]benzoic acid Traditional Name: 5-bromo-2-[3-(4-chlorophenoxy)propylamino]benzoic acid Formula: C16H15BrClNO3 MolecularWeight: 384.6522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCNC2=C(C=C(C=C2)Br)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1OCCCNC2=C(C=C(C=C2)Br)C(=O)O)Cl

InChI

InChI=1S/C16H15BrClNO3/c17-11-2-7-15(14(10-11)16(20)21)19-8-1-9-22-13-5-3-12(18)4-6-13/h2-7,10,19H,1,8-9H2,(H,20,21)