[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)prop-2-enoate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-5-methoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] (E)-3-(3-chloro-5-methoxy-4-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-5-methoxy-4-propoxyphenyl)-2-propenoic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] (E)-3-(3-chloro-5-methoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-5-methoxy-4-propoxy-phenyl)acrylic acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H27ClN2O6 MolecularWeight: 426.89118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C=CC(=O)OCC(=O)NC(=O)NC(C)(C)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)/C=C/C(=O)OCC(=O)NC(=O)NC(C)(C)C)OC

InChI

InChI=1S/C20H27ClN2O6/c1-6-9-28-18-14(21)10-13(11-15(18)27-5)7-8-17(25)29-12-16(24)22-19(26)23-20(2,3)4/h7-8,10-11H,6,9,12H2,1-5H3,(H2,22,23,24,26)/b8-7+