[2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-(6-methoxy-1-benzofuran-3-yl)ethanoate

Systemtic Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-(6-methoxy-1-benzofuran-3-yl)ethanoate Openeye Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxo-ethyl] 2-(6-methoxybenzofuran-3-yl)acetate CAS Name: 2-(6-methoxy-3-benzofuranyl)acetic acid [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] 2-(6-methoxy-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methoxybenzofuran-3-yl)acetic acid [2-[1-(4-bromophenyl)ethylamino]-2-keto-ethyl] ester Formula: C21H20BrNO5 MolecularWeight: 446.2912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)COC(=O)CC2=COC3=C2C=CC(=C3)OC

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(=O)COC(=O)CC2=COC3=C2C=CC(=C3)OC

InChI

InChI=1S/C21H20BrNO5/c1-13(14-3-5-16(22)6-4-14)23-20(24)12-28-21(25)9-15-11-27-19-10-17(26-2)7-8-18(15)19/h3-8,10-11,13H,9,12H2,1-2H3,(H,23,24)