[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 2-azanyl-3,5-bis(chloranyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 2-azanyl-3,5-bis(chloranyl)benzoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 2-amino-3,5-dichloro-benzoate CAS Name: 2-amino-3,5-dichlorobenzoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 2-amino-3,5-dichlorobenzoate Traditional Name: 2-amino-3,5-dichloro-benzoic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H13Cl2N3O4 MolecularWeight: 346.16602

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)C1=CC(=CC(=C1N)Cl)Cl

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)C1=CC(=CC(=C1N)Cl)Cl

InChI

InChI=1S/C13H13Cl2N3O4/c1-2-3-17-13(21)18-10(19)6-22-12(20)8-4-7(14)5-9(15)11(8)16/h2,4-5H,1,3,6,16H2,(H2,17,18,19,21)