methyl 2-[[5-bromanyl-2-(2-methylpropoxy)phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[5-bromanyl-2-(2-methylpropoxy)phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(5-bromo-2-isobutoxy-benzoyl)amino]-3-phenyl-propanoate CAS Name: 2-[[[5-bromo-2-(2-methylpropoxy)phenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[5-bromo-2-(2-methylpropoxy)benzoyl]amino]-3-phenylpropanoate Traditional Name: 2-[(5-bromo-2-isobutoxy-benzoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C21H24BrNO4/c1-14(2)13-27-19-10-9-16(22)12-17(19)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)