[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 2-(3-chloranylphenoxy)propanoate

Systemtic Name: [2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 2-(3-chloranylphenoxy)propanoate Openeye Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl] 2-(3-chlorophenoxy)propanoate CAS Name: 2-(3-chlorophenoxy)propanoic acid [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 2-(3-chlorophenoxy)propanoate Traditional Name: 2-(3-chlorophenoxy)propionic acid [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-keto-ethyl] ester Formula: C20H18ClNO7 MolecularWeight: 419.81242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC2=C(C=C1C(=O)C)OCO2)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)OCC(=O)NC1=CC2=C(C=C1C(=O)C)OCO2)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H18ClNO7/c1-11(23)15-7-17-18(28-10-27-17)8-16(15)22-19(24)9-26-20(25)12(2)29-14-5-3-4-13(21)6-14/h3-8,12H,9-10H2,1-2H3,(H,22,24)