2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid 2-phthalimidoethyl ester Formula: C20H14BrNO5 MolecularWeight: 428.23286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H14BrNO5/c1-11-15-10-12(21)6-7-16(15)27-17(11)20(25)26-9-8-22-18(23)13-4-2-3-5-14(13)19(22)24/h2-7,10H,8-9H2,1H3