butyl 4-[2-(3-acetamido-3-thiophen-2-yl-propanoyl)oxyethanoylamino]benzoate

Systemtic Name: butyl 4-[2-(3-acetamido-3-thiophen-2-yl-propanoyl)oxyethanoylamino]benzoate Openeye Name: butyl 4-[[2-[3-acetamido-3-(2-thienyl)propanoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-(3-acetamido-1-oxo-3-thiophen-2-ylpropoxy)-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(3-acetamido-3-thiophen-2-ylpropanoyl)oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[3-acetamido-3-(2-thienyl)propanoyl]oxyacetyl]amino]benzoic acid butyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CC(C2=CC=CS2)NC(=O)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CC(C2=CC=CS2)NC(=O)C

InChI

InChI=1S/C22H26N2O6S/c1-3-4-11-29-22(28)16-7-9-17(10-8-16)24-20(26)14-30-21(27)13-18(23-15(2)25)19-6-5-12-31-19/h5-10,12,18H,3-4,11,13-14H2,1-2H3,(H,23,25)(H,24,26)