[2-[(2-bromophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 3-(ethoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [2-[(2-bromophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: [2-[(2-bromophenyl)methyl-methyl-amino]-2-oxo-ethyl] 3-(ethoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(ethoxymethyl)-2-benzofurancarboxylic acid [2-[(2-bromophenyl)methyl-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-bromophenyl)methyl-methylamino]-2-oxoethyl] 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(ethoxymethyl)coumarilic acid [2-[(2-bromobenzyl)-methyl-amino]-2-keto-ethyl] ester Formula: C22H22BrNO5 MolecularWeight: 460.31778

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)N(C)CC3=CC=CC=C3Br

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)N(C)CC3=CC=CC=C3Br

InChI

InChI=1S/C22H22BrNO5/c1-3-27-13-17-16-9-5-7-11-19(16)29-21(17)22(26)28-14-20(25)24(2)12-15-8-4-6-10-18(15)23/h4-11H,3,12-14H2,1-2H3