bis[2-(3-phenoxyphenyl)heptanoyloxy]alumanylium

Systemtic Name: bis[2-(3-phenoxyphenyl)heptanoyloxy]alumanylium Openeye Name: bis[2-(3-phenoxyphenyl)heptanoyloxy]alumanylium CAS Name: bis[1-oxo-2-(3-phenoxyphenyl)heptoxy]alumanylium IUPAC Name: bis[2-(3-phenoxyphenyl)heptanoyloxy]alumanylium Traditional Name: bis[2-(3-phenoxyphenyl)heptanoyloxy]alumanylium Formula: C38H42AlO6+ MolecularWeight: 621.718018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)O[Al+]OC(=O)C(CCCCC)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCCCC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)O[Al+]OC(=O)C(CCCCC)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/2C19H22O3.Al/c2*1-2-3-5-13-18(19(20)21)15-9-8-12-17(14-15)22-16-10-6-4-7-11-16;/h2*4,6-12,14,18H,2-3,5,13H2,1H3,(H,20,21);/q;;+3/p-2