[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-[(4-chloranylphenoxy)methyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-[(4-chloranylphenoxy)methyl]benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 4-[(4-chlorophenoxy)methyl]benzoate CAS Name: 4-[(4-chlorophenoxy)methyl]benzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 4-[(4-chlorophenoxy)methyl]benzoate Traditional Name: 4-[(4-chlorophenoxy)methyl]benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H21ClN2O5 MolecularWeight: 404.84414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H21ClN2O5/c1-13(2)22-20(26)23-18(24)12-28-19(25)15-5-3-14(4-6-15)11-27-17-9-7-16(21)8-10-17/h3-10,13H,11-12H2,1-2H3,(H2,22,23,24,26)