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

Systemtic Name: [4-[(3,4-dimethoxyphenyl)carbamoylamino]-2-propanoyl-phenyl] propaneperoxoate Openeye Name: [4-[(3,4-dimethoxyphenyl)carbamoylamino]-2-propanoyl-phenyl] propaneperoxoate CAS Name: propaneperoxoic acid [4-[[(3,4-dimethoxyanilino)-oxomethyl]amino]-2-(1-oxopropyl)phenyl] ester IUPAC Name: [4-[(3,4-dimethoxyphenyl)carbamoylamino]-2-propanoylphenyl] propaneperoxoate Traditional Name: peroxypropionic acid [4-[(3,4-dimethoxyphenyl)carbamoylamino]-2-propionyl-phenyl] ester Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O7/c1-5-16(24)15-11-13(7-9-17(15)29-30-20(25)6-2)22-21(26)23-14-8-10-18(27-3)19(12-14)28-4/h7-12H,5-6H2,1-4H3,(H2,22,23,26)