methyl 2-[3-(4-bromanylphenoxy)propylamino]-3-chloranyl-benzoate

Systemtic Name: methyl 2-[3-(4-bromanylphenoxy)propylamino]-3-chloranyl-benzoate Openeye Name: methyl 2-[3-(4-bromophenoxy)propylamino]-3-chloro-benzoate CAS Name: 2-[3-(4-bromophenoxy)propylamino]-3-chlorobenzoic acid methyl ester IUPAC Name: methyl 2-[3-(4-bromophenoxy)propylamino]-3-chlorobenzoate Traditional Name: 2-[3-(4-bromophenoxy)propylamino]-3-chloro-benzoic acid methyl ester Formula: C17H17BrClNO3 MolecularWeight: 398.67878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrClNO3/c1-22-17(21)14-4-2-5-15(19)16(14)20-10-3-11-23-13-8-6-12(18)7-9-13/h2,4-9,20H,3,10-11H2,1H3