aluminum; 4-ethyl-2-methyl-quinolin-8-olate; 4-methylphenolate

Systemtic Name: aluminum; 4-ethyl-2-methyl-quinolin-8-olate; 4-methylphenolate Openeye Name: aluminum; 4-ethyl-2-methyl-quinolin-8-olate; 4-methylphenolate CAS Name: aluminum; 4-ethyl-2-methyl-8-quinolinolate; 4-methylphenolate IUPAC Name: aluminum; 4-ethyl-2-methylquinolin-8-olate; 4-methylphenolate Traditional Name: aluminum; 4-ethyl-2-methyl-quinolin-8-olate; 4-methylphenolate Formula: C31H31AlN2O3 MolecularWeight: 506.570978

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC2=C1C=CC=C2[O-])C.CCC1=CC(=NC2=C1C=CC=C2[O-])C.CC1=CC=C(C=C1)[O-].[Al+3]

Isomeric SMILES

CCC1=CC(=NC2=C1C=CC=C2[O-])C.CCC1=CC(=NC2=C1C=CC=C2[O-])C.CC1=CC=C(C=C1)[O-].[Al+3]

InChI

InChI=1S/2C12H13NO.C7H8O.Al/c2*1-3-9-7-8(2)13-12-10(9)5-4-6-11(12)14;1-6-2-4-7(8)5-3-6;/h2*4-7,14H,3H2,1-2H3;2-5,8H,1H3;/q;;;+3/p-3