methyl 2-[2-(4-bromanyl-2-propan-2-yl-phenoxy)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[2-(4-bromanyl-2-propan-2-yl-phenoxy)ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[2-(4-bromo-2-isopropyl-phenoxy)acetyl]amino]-3-phenyl-propanoate CAS Name: 2-[[2-(4-bromo-2-propan-2-ylphenoxy)-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-bromo-2-propan-2-ylphenoxy)acetyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-(4-bromo-2-isopropyl-phenoxy)acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)Br)OCC(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)Br)OCC(=O)NC(CC2=CC=CC=C2)C(=O)OC

InChI

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