methyl 2-[2-(4-bromanylphenoxy)ethylamino]-5-methyl-benzoate

Systemtic Name: methyl 2-[2-(4-bromanylphenoxy)ethylamino]-5-methyl-benzoate Openeye Name: methyl 2-[2-(4-bromophenoxy)ethylamino]-5-methyl-benzoate CAS Name: 2-[2-(4-bromophenoxy)ethylamino]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[2-(4-bromophenoxy)ethylamino]-5-methylbenzoate Traditional Name: 2-[2-(4-bromophenoxy)ethylamino]-5-methyl-benzoic acid methyl ester Formula: C17H18BrNO3 MolecularWeight: 364.23372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCCOC2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NCCOC2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C17H18BrNO3/c1-12-3-8-16(15(11-12)17(20)21-2)19-9-10-22-14-6-4-13(18)5-7-14/h3-8,11,19H,9-10H2,1-2H3