methyl 1-(4-bromanyl-3-methyl-phenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(4-bromanyl-3-methyl-phenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(4-bromo-3-methyl-phenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(4-bromo-3-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromo-3-methylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(4-bromo-3-methyl-phenyl)sulfonylpyrrolidine-2-carboxylic acid methyl ester Formula: C13H16BrNO4S MolecularWeight: 362.23944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrNO4S/c1-9-8-10(5-6-11(9)14)20(17,18)15-7-3-4-12(15)13(16)19-2/h5-6,8,12H,3-4,7H2,1-2H3