acetyloxy-(2-methyl-5-phenoxy-phenyl)alumanylium

Systemtic Name: acetyloxy-(2-methyl-5-phenoxy-phenyl)alumanylium Openeye Name: acetoxy-(2-methyl-5-phenoxy-phenyl)alumanylium CAS Name: acetyloxy-(2-methyl-5-phenoxyphenyl)alumanylium IUPAC Name: acetyloxy-(2-methyl-5-phenoxyphenyl)alumanylium Traditional Name: acetoxy-(2-methyl-5-phenoxy-phenyl)alumanylium Formula: C15H14AlO3+ MolecularWeight: 269.251398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=CC=CC=C2)[Al+]OC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=CC=CC=C2)[Al+]OC(=O)C

InChI

InChI=1S/C13H11O.C2H4O2.Al/c1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12;1-2(3)4;/h2-7,9-10H,1H3;1H3,(H,3,4);/q;;+2/p-1