[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H16ClN3O4 MolecularWeight: 313.73684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C1=CC(=C(C=C1)Cl)N

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)C1=CC(=C(C=C1)Cl)N

InChI

InChI=1S/C13H16ClN3O4/c1-7(2)16-13(20)17-11(18)6-21-12(19)8-3-4-9(14)10(15)5-8/h3-5,7H,6,15H2,1-2H3,(H2,16,17,18,20)