propyl 3-[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]benzoate

Systemtic Name: propyl 3-[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]benzoate Openeye Name: propyl 3-[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]benzoate CAS Name: 3-[[2-(2-bromo-4-propan-2-ylphenoxy)-1-oxoethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 3-[[2-(2-bromo-4-propan-2-ylphenoxy)acetyl]amino]benzoate Traditional Name: 3-[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]benzoic acid propyl ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2)C(C)C)Br

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2)C(C)C)Br

InChI

InChI=1S/C21H24BrNO4/c1-4-10-26-21(25)16-6-5-7-17(11-16)23-20(24)13-27-19-9-8-15(14(2)3)12-18(19)22/h5-9,11-12,14H,4,10,13H2,1-3H3,(H,23,24)