methyl 3-bromanyl-4-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-bromanyl-4-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-bromo-4-[2-[2-(3-methylphenoxy)ethylamino]-2-oxo-ethoxy]benzoate CAS Name: 3-bromo-4-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethoxy]benzoate Traditional Name: 3-bromo-4-[2-keto-2-[2-(3-methylphenoxy)ethylamino]ethoxy]benzoic acid methyl ester Formula: C19H20BrNO5 MolecularWeight: 422.2698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)COC2=C(C=C(C=C2)C(=O)OC)Br

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)COC2=C(C=C(C=C2)C(=O)OC)Br

InChI

InChI=1S/C19H20BrNO5/c1-13-4-3-5-15(10-13)25-9-8-21-18(22)12-26-17-7-6-14(11-16(17)20)19(23)24-2/h3-7,10-11H,8-9,12H2,1-2H3,(H,21,22)