(2-bromanyl-4,5-diethoxy-phenyl)methyl 2-[(3,4-dimethylphenyl)carbonylamino]ethanoate

Systemtic Name: (2-bromanyl-4,5-diethoxy-phenyl)methyl 2-[(3,4-dimethylphenyl)carbonylamino]ethanoate Openeye Name: (2-bromo-4,5-diethoxy-phenyl)methyl 2-[(3,4-dimethylbenzoyl)amino]acetate CAS Name: 2-[[(3,4-dimethylphenyl)-oxomethyl]amino]acetic acid (2-bromo-4,5-diethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-diethoxyphenyl)methyl 2-[(3,4-dimethylbenzoyl)amino]acetate Traditional Name: 2-[(3,4-dimethylbenzoyl)amino]acetic acid (2-bromo-4,5-diethoxy-benzyl) ester Formula: C22H26BrNO5 MolecularWeight: 464.34954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)COC(=O)CNC(=O)C2=CC(=C(C=C2)C)C)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)COC(=O)CNC(=O)C2=CC(=C(C=C2)C)C)Br)OCC

InChI

InChI=1S/C22H26BrNO5/c1-5-27-19-10-17(18(23)11-20(19)28-6-2)13-29-21(25)12-24-22(26)16-8-7-14(3)15(4)9-16/h7-11H,5-6,12-13H2,1-4H3,(H,24,26)