[2-[(4-bromanyl-2-ethyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromanyl-2-ethyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2-ethyl-anilino)-2-oxo-ethyl] 1-(2-furylmethyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(2-furanylmethyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-2-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-ethylanilino)-2-oxoethyl] 1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(2-furfuryl)-5-keto-pyrrolidine-3-carboxylic acid [2-(4-bromo-2-ethyl-anilino)-2-keto-ethyl] ester Formula: C20H21BrN2O5 MolecularWeight: 449.29514

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)NC(=O)COC(=O)C2CC(=O)N(C2)CC3=CC=CO3

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)NC(=O)COC(=O)C2CC(=O)N(C2)CC3=CC=CO3

InChI

InChI=1S/C20H21BrN2O5/c1-2-13-8-15(21)5-6-17(13)22-18(24)12-28-20(26)14-9-19(25)23(10-14)11-16-4-3-7-27-16/h3-8,14H,2,9-12H2,1H3,(H,22,24)