methyl 1-(4-bromanyl-2-methyl-phenyl)carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(4-bromanyl-2-methyl-phenyl)carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(4-bromo-2-methyl-benzoyl)pyrrolidine-2-carboxylate CAS Name: 1-[(4-bromo-2-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromo-2-methylbenzoyl)pyrrolidine-2-carboxylate Traditional Name: 1-(4-bromo-2-methyl-benzoyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C14H16BrNO3 MolecularWeight: 326.18574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)C(=O)N2CCCC2C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)C(=O)N2CCCC2C(=O)OC

InChI

InChI=1S/C14H16BrNO3/c1-9-8-10(15)5-6-11(9)13(17)16-7-3-4-12(16)14(18)19-2/h5-6,8,12H,3-4,7H2,1-2H3