butyl 4-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazol-3-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazol-3-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)isoxazole-3-carbonyl]amino]benzoate CAS Name: 4-[[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-isoxazolyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carbonyl]amino]benzoate Traditional Name: 4-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)isoxazole-3-carbonyl]amino]benzoic acid butyl ester Formula: C23H22N2O6 MolecularWeight: 422.43058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NOC(=C2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NOC(=C2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H22N2O6/c1-2-3-10-30-23(27)15-4-7-17(8-5-15)24-22(26)18-14-20(31-25-18)16-6-9-19-21(13-16)29-12-11-28-19/h4-9,13-14H,2-3,10-12H2,1H3,(H,24,26)