methyl 2-[(4-bromanyl-3,5-dimethyl-phenyl)carbonylamino]pentanoate

Systemtic Name: methyl 2-[(4-bromanyl-3,5-dimethyl-phenyl)carbonylamino]pentanoate Openeye Name: methyl 2-[(4-bromo-3,5-dimethyl-benzoyl)amino]pentanoate CAS Name: 2-[[(4-bromo-3,5-dimethylphenyl)-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-3,5-dimethylbenzoyl)amino]pentanoate Traditional Name: 2-[(4-bromo-3,5-dimethyl-benzoyl)amino]valeric acid methyl ester Formula: C15H20BrNO3 MolecularWeight: 342.2282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC)NC(=O)C1=CC(=C(C(=C1)C)Br)C

Isomeric SMILES

CCCC(C(=O)OC)NC(=O)C1=CC(=C(C(=C1)C)Br)C

InChI

InChI=1S/C15H20BrNO3/c1-5-6-12(15(19)20-4)17-14(18)11-7-9(2)13(16)10(3)8-11/h7-8,12H,5-6H2,1-4H3,(H,17,18)