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

Systemtic Name: ethyl 3-[2-(4-bromanyl-3-methyl-phenoxy)ethanoyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-[2-(4-bromo-3-methyl-phenoxy)acetyl]amino]propanoate CAS Name: 3-[[2-(4-bromo-3-methylphenoxy)-1-oxoethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-[2-(4-bromo-3-methylphenoxy)acetyl]amino]propanoate Traditional Name: 3-[benzyl-[2-(4-bromo-3-methyl-phenoxy)acetyl]amino]propionic acid ethyl ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrNO4/c1-3-26-21(25)11-12-23(14-17-7-5-4-6-8-17)20(24)15-27-18-9-10-19(22)16(2)13-18/h4-10,13H,3,11-12,14-15H2,1-2H3