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

Systemtic Name: methyl 5-bromanyl-2-[4-(4-methylphenoxy)butylamino]benzoate Openeye Name: methyl 5-bromo-2-[4-(4-methylphenoxy)butylamino]benzoate CAS Name: 5-bromo-2-[4-(4-methylphenoxy)butylamino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[4-(4-methylphenoxy)butylamino]benzoate Traditional Name: 5-bromo-2-[4-(4-methylphenoxy)butylamino]benzoic acid methyl ester Formula: C19H22BrNO3 MolecularWeight: 392.28688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCCNC2=C(C=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)OCCCCNC2=C(C=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C19H22BrNO3/c1-14-5-8-16(9-6-14)24-12-4-3-11-21-18-10-7-15(20)13-17(18)19(22)23-2/h5-10,13,21H,3-4,11-12H2,1-2H3