[[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonylamino]methylaluminum dihydrate

Systemtic Name: [[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonylamino]methylaluminum dihydrate Openeye Name: [[3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbonyl]amino]methylaluminum dihydrate CAS Name: [[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-oxomethyl]amino]methylaluminum dihydrate IUPAC Name: [[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]methylaluminum dihydrate Traditional Name: [[3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbonyl]amino]methylaluminum dihydrate Formula: C12H14AlClN2O4 MolecularWeight: 312.685098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC[Al].O.O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC[Al].O.O

InChI

InChI=1S/C12H10ClN2O2.Al.2H2O/c1-7-10(12(16)14-2)11(15-17-7)8-5-3-4-6-9(8)13;;;/h3-6H,2H2,1H3,(H,14,16);;2*1H2