[5-bromanyl-2-[1-(2,2-dimethylpropanoylamino)ethyl]phenyl]methyl methanesulfonate

Systemtic Name: [5-bromanyl-2-[1-(2,2-dimethylpropanoylamino)ethyl]phenyl]methyl methanesulfonate Openeye Name: [5-bromo-2-[1-(2,2-dimethylpropanoylamino)ethyl]phenyl]methyl methanesulfonate CAS Name: methanesulfonic acid [5-bromo-2-[1-[(2,2-dimethyl-1-oxopropyl)amino]ethyl]phenyl]methyl ester IUPAC Name: [5-bromo-2-[1-(2,2-dimethylpropanoylamino)ethyl]phenyl]methyl methanesulfonate Traditional Name: methanesulfonic acid [5-bromo-2-[1-(pivaloylamino)ethyl]benzyl] ester Formula: C15H22BrNO4S MolecularWeight: 392.30848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Br)COS(=O)(=O)C)NC(=O)C(C)(C)C

Isomeric SMILES

CC(C1=C(C=C(C=C1)Br)COS(=O)(=O)C)NC(=O)C(C)(C)C

InChI

InChI=1S/C15H22BrNO4S/c1-10(17-14(18)15(2,3)4)13-7-6-12(16)8-11(13)9-21-22(5,19)20/h6-8,10H,9H2,1-5H3,(H,17,18)