2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]carbonyl-methyl-amino]ethanoate

Systemtic Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]carbonyl-methyl-amino]ethanoate Openeye Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazole-4-carbonyl]-methyl-amino]acetate CAS Name: 2-[[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]-oxomethyl]-methylamino]acetate IUPAC Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazole-4-carbonyl]-methylamino]acetate Traditional Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazole-4-carbonyl]-methyl-amino]acetate Formula: C21H18N3O5- MolecularWeight: 392.38472

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)[O-])C(=O)C1=CN(N=C1C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4

Isomeric SMILES

CN(CC(=O)[O-])C(=O)C1=CN(N=C1C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O5/c1-23(13-19(25)26)21(27)16-12-24(15-5-3-2-4-6-15)22-20(16)14-7-8-17-18(11-14)29-10-9-28-17/h2-8,11-12H,9-10,13H2,1H3,(H,25,26)/p-1