[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] 4-butoxy-3-chloro-5-ethoxy-benzoate CAS Name: 4-butoxy-3-chloro-5-ethoxybenzoic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 4-butoxy-3-chloro-5-ethoxybenzoate Traditional Name: 4-butoxy-3-chloro-5-ethoxy-benzoic acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H29ClN2O6 MolecularWeight: 428.90706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC(=O)NC(C)(C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC(=O)NC(C)(C)C)OCC

InChI

InChI=1S/C20H29ClN2O6/c1-6-8-9-28-17-14(21)10-13(11-15(17)27-7-2)18(25)29-12-16(24)22-19(26)23-20(3,4)5/h10-11H,6-9,12H2,1-5H3,(H2,22,23,24,26)