ethyl 3-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]propanoate CAS Name: 3-[[2-(2-bromo-4-tert-butylphenoxy)-1-oxoethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-[2-(2-bromo-4-tert-butylphenoxy)acetyl]amino]propanoate Traditional Name: 3-[benzyl-[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]propionic acid ethyl ester Formula: C24H30BrNO4 MolecularWeight: 476.4033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)COC2=C(C=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)COC2=C(C=C(C=C2)C(C)(C)C)Br

InChI

InChI=1S/C24H30BrNO4/c1-5-29-23(28)13-14-26(16-18-9-7-6-8-10-18)22(27)17-30-21-12-11-19(15-20(21)25)24(2,3)4/h6-12,15H,5,13-14,16-17H2,1-4H3