[4-[(3,4-dimethoxyphenyl)carbamoylamino]-2-propanoyl-phenyl] ethaneperoxoate

Systemtic Name: [4-[(3,4-dimethoxyphenyl)carbamoylamino]-2-propanoyl-phenyl] ethaneperoxoate Openeye Name: [4-[(3,4-dimethoxyphenyl)carbamoylamino]-2-propanoyl-phenyl] peroxyacetate CAS Name: ethaneperoxoic acid [4-[[(3,4-dimethoxyanilino)-oxomethyl]amino]-2-(1-oxopropyl)phenyl] ester IUPAC Name: [4-[(3,4-dimethoxyphenyl)carbamoylamino]-2-propanoylphenyl] ethaneperoxoate Traditional Name: peracetic acid [4-[(3,4-dimethoxyphenyl)carbamoylamino]-2-propionyl-phenyl] ester Formula: C20H22N2O7 MolecularWeight: 402.39788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)OC)OC)OOC(=O)C

Isomeric SMILES

CCC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)OC)OC)OOC(=O)C

InChI

InChI=1S/C20H22N2O7/c1-5-16(24)15-10-13(6-8-17(15)29-28-12(2)23)21-20(25)22-14-7-9-18(26-3)19(11-14)27-4/h6-11H,5H2,1-4H3,(H2,21,22,25)