2-(3,5-dimethylphenoxy)ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C20H21NO6 MolecularWeight: 371.38384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C20H21NO6/c1-13-7-14(2)9-16(8-13)24-5-6-25-19(22)11-21-20(23)15-3-4-17-18(10-15)27-12-26-17/h3-4,7-10H,5-6,11-12H2,1-2H3,(H,21,23)