dimethyl (2S,4R)-4-[(4-bromanyl-3-methyl-phenyl)methyl]-5-oxidanylidene-pyrrolidine-1,2-dicarboxylate

Systemtic Name: dimethyl (2S,4R)-4-[(4-bromanyl-3-methyl-phenyl)methyl]-5-oxidanylidene-pyrrolidine-1,2-dicarboxylate Openeye Name: dimethyl (2S,4R)-4-[(4-bromo-3-methyl-phenyl)methyl]-5-oxo-pyrrolidine-1,2-dicarboxylate CAS Name: (2S,4R)-4-[(4-bromo-3-methylphenyl)methyl]-5-oxopyrrolidine-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,4R)-4-[(4-bromo-3-methylphenyl)methyl]-5-oxopyrrolidine-1,2-dicarboxylate Traditional Name: (2S,4R)-4-(4-bromo-3-methyl-benzyl)-5-keto-pyrrolidine-1,2-dicarboxylic acid dimethyl ester Formula: C16H18BrNO5 MolecularWeight: 384.22182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC2CC(N(C2=O)C(=O)OC)C(=O)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C[C@@H]2C[C@H](N(C2=O)C(=O)OC)C(=O)OC)Br

InChI

InChI=1S/C16H18BrNO5/c1-9-6-10(4-5-12(9)17)7-11-8-13(15(20)22-2)18(14(11)19)16(21)23-3/h4-6,11,13H,7-8H2,1-3H3/t11-,13+/m1/s1