aluminum 4-(2-chlorophenyl)carbonyl-2,5-dimethyl-1H-pyrazol-3-one

Systemtic Name: aluminum 4-(2-chlorophenyl)carbonyl-2,5-dimethyl-1H-pyrazol-3-one Openeye Name: aluminum 4-(2-chlorobenzoyl)-2,5-dimethyl-1H-pyrazol-3-one CAS Name: aluminum 4-[(2-chlorophenyl)-oxomethyl]-2,5-dimethyl-1H-pyrazol-3-one IUPAC Name: aluminum 4-(2-chlorobenzoyl)-2,5-dimethyl-1H-pyrazol-3-one Traditional Name: aluminum 4-(2-chlorobenzoyl)-2,5-dimethyl-3-pyrazolin-3-one Formula: C12H11AlClN2O2+3 MolecularWeight: 277.662478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C)C(=O)C2=CC=CC=C2Cl.[Al+3]

Isomeric SMILES

CC1=C(C(=O)N(N1)C)C(=O)C2=CC=CC=C2Cl.[Al+3]

InChI

InChI=1S/C12H11ClN2O2.Al/c1-7-10(12(17)15(2)14-7)11(16)8-5-3-4-6-9(8)13;/h3-6,14H,1-2H3;/q;+3