[2-[(4-bromanyl-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-[(2-methoxyphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromanyl-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-[(2-methoxyphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-3-chloro-anilino)-2-oxo-ethyl] 1-[(2-methoxybenzoyl)amino]-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-[[(2-methoxyphenyl)-oxomethyl]amino]-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-3-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-chloroanilino)-2-oxoethyl] 1-[(2-methoxybenzoyl)amino]-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(o-anisoylamino)pyrrolidine-3-carboxylic acid [2-(4-bromo-3-chloro-anilino)-2-keto-ethyl] ester Formula: C21H19BrClN3O6 MolecularWeight: 524.74906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NN2CC(CC2=O)C(=O)OCC(=O)NC3=CC(=C(C=C3)Br)Cl

Isomeric SMILES

COC1=CC=CC=C1C(=O)NN2CC(CC2=O)C(=O)OCC(=O)NC3=CC(=C(C=C3)Br)Cl

InChI

InChI=1S/C21H19BrClN3O6/c1-31-17-5-3-2-4-14(17)20(29)25-26-10-12(8-19(26)28)21(30)32-11-18(27)24-13-6-7-15(22)16(23)9-13/h2-7,9,12H,8,10-11H2,1H3,(H,24,27)(H,25,29)