ethyl 4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazole-4-carbonyl]amino]benzoic acid ethyl ester Formula: C27H23N3O5 MolecularWeight: 469.48862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

InChI

InChI=1S/C27H23N3O5/c1-2-33-27(32)18-8-11-20(12-9-18)28-26(31)22-17-30(21-6-4-3-5-7-21)29-25(22)19-10-13-23-24(16-19)35-15-14-34-23/h3-13,16-17H,2,14-15H2,1H3,(H,28,31)