(2-bromanyl-4-ethoxycarbonyl-phenyl)methyl 3-acetamido-4-methyl-benzoate

Systemtic Name: (2-bromanyl-4-ethoxycarbonyl-phenyl)methyl 3-acetamido-4-methyl-benzoate Openeye Name: (2-bromo-4-ethoxycarbonyl-phenyl)methyl 3-acetamido-4-methyl-benzoate CAS Name: 3-acetamido-4-methylbenzoic acid (2-bromo-4-ethoxycarbonylphenyl)methyl ester IUPAC Name: (2-bromo-4-ethoxycarbonylphenyl)methyl 3-acetamido-4-methylbenzoate Traditional Name: 3-acetamido-4-methyl-benzoic acid (2-bromo-4-carbethoxy-benzyl) ester Formula: C20H20BrNO5 MolecularWeight: 434.2805

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)COC(=O)C2=CC(=C(C=C2)C)NC(=O)C)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)COC(=O)C2=CC(=C(C=C2)C)NC(=O)C)Br

InChI

InChI=1S/C20H20BrNO5/c1-4-26-19(24)14-7-8-16(17(21)9-14)11-27-20(25)15-6-5-12(2)18(10-15)22-13(3)23/h5-10H,4,11H2,1-3H3,(H,22,23)