1-[4-[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[4-[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: 1-[4-[2-(2-bromo-4-methyl-anilino)-2-oxo-ethoxy]phenyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: 1-[4-[2-(2-bromo-4-methylanilino)-2-oxoethoxy]phenyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[2-(2-bromo-4-methylanilino)-2-oxoethoxy]phenyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: 1-[4-[2-(2-bromo-4-methyl-anilino)-2-keto-ethoxy]phenyl]-5-keto-pyrrolidine-3-carboxylic acid Formula: C20H19BrN2O5 MolecularWeight: 447.27926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC2=CC=C(C=C2)N3CC(CC3=O)C(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC2=CC=C(C=C2)N3CC(CC3=O)C(=O)O)Br

InChI

InChI=1S/C20H19BrN2O5/c1-12-2-7-17(16(21)8-12)22-18(24)11-28-15-5-3-14(4-6-15)23-10-13(20(26)27)9-19(23)25/h2-8,13H,9-11H2,1H3,(H,22,24)(H,26,27)