[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-benzoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoate CAS Name: 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoate Traditional Name: 4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H18ClN3O8 MolecularWeight: 463.82522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC(=O)NC(=O)NCC=C)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC(=O)NC(=O)NCC=C)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN3O8/c1-3-8-22-20(27)23-18(25)11-31-19(26)12-4-6-16(17(9-12)30-2)32-15-7-5-13(21)10-14(15)24(28)29/h3-7,9-10H,1,8,11H2,2H3,(H2,22,23,25,27)