3-methylbutyl 4-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethanoylamino]benzoate

Systemtic Name: 3-methylbutyl 4-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethanoylamino]benzoate Openeye Name: isopentyl 4-[[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethyl]amino]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]acetyl]amino]benzoic acid isoamyl ester Formula: C28H39NO4 MolecularWeight: 453.61356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)C(C)(C)CC(C)(C)C

Isomeric SMILES

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C28H39NO4/c1-20(2)16-17-32-26(31)21-8-12-23(13-9-21)29-25(30)18-33-24-14-10-22(11-15-24)28(6,7)19-27(3,4)5/h8-15,20H,16-19H2,1-7H3,(H,29,30)