[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(6-methoxy-1-benzofuran-3-yl)ethanoate

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(6-methoxy-1-benzofuran-3-yl)ethanoate Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl] 2-(6-methoxybenzofuran-3-yl)acetate CAS Name: 2-(6-methoxy-3-benzofuranyl)acetic acid [2-(2-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl] 2-(6-methoxy-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methoxybenzofuran-3-yl)acetic acid [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C20H18BrNO5 MolecularWeight: 432.26462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)CC2=COC3=C2C=CC(=C3)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)CC2=COC3=C2C=CC(=C3)OC)Br

InChI

InChI=1S/C20H18BrNO5/c1-12-3-6-17(16(21)7-12)22-19(23)11-27-20(24)8-13-10-26-18-9-14(25-2)4-5-15(13)18/h3-7,9-10H,8,11H2,1-2H3,(H,22,23)