methyl 5-bromanyl-2-[4-(4-chloranylphenoxy)butylamino]benzoate

Systemtic Name: methyl 5-bromanyl-2-[4-(4-chloranylphenoxy)butylamino]benzoate Openeye Name: methyl 5-bromo-2-[4-(4-chlorophenoxy)butylamino]benzoate CAS Name: 5-bromo-2-[4-(4-chlorophenoxy)butylamino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[4-(4-chlorophenoxy)butylamino]benzoate Traditional Name: 5-bromo-2-[4-(4-chlorophenoxy)butylamino]benzoic acid methyl ester Formula: C18H19BrClNO3 MolecularWeight: 412.70536

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NCCCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NCCCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H19BrClNO3/c1-23-18(22)16-12-13(19)4-9-17(16)21-10-2-3-11-24-15-7-5-14(20)6-8-15/h4-9,12,21H,2-3,10-11H2,1H3