methyl 2-[[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[3-(1,3-benzodioxol-5-yl)-1H-pyrazole-5-carbonyl]amino]acetate CAS Name: 2-[[[3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-yl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-(1,3-benzodioxol-5-yl)-1H-pyrazole-5-carbonyl]amino]acetate Traditional Name: 2-[[3-(1,3-benzodioxol-5-yl)-1H-pyrazole-5-carbonyl]amino]acetic acid methyl ester Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC(=NN1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)CNC(=O)C1=CC(=NN1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H13N3O5/c1-20-13(18)6-15-14(19)10-5-9(16-17-10)8-2-3-11-12(4-8)22-7-21-11/h2-5H,6-7H2,1H3,(H,15,19)(H,16,17)