pentyl 4-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethanoylamino]benzoate

Systemtic Name: pentyl 4-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethanoylamino]benzoate Openeye Name: pentyl 4-[[2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[[2-[4-(2-phenylpropan-2-yl)phenoxy]acetyl]amino]benzoate Traditional Name: 4-[[2-(4-cumylphenoxy)acetyl]amino]benzoic acid amyl ester Formula: C29H33NO4 MolecularWeight: 459.57662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)C(C)(C)C3=CC=CC=C3

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)C(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C29H33NO4/c1-4-5-9-20-33-28(32)22-12-16-25(17-13-22)30-27(31)21-34-26-18-14-24(15-19-26)29(2,3)23-10-7-6-8-11-23/h6-8,10-19H,4-5,9,20-21H2,1-3H3,(H,30,31)