heptastrontium; ethane-1,1,1,2,2,2-hexolate; 2-nonylphenolate

Systemtic Name: heptastrontium; ethane-1,1,1,2,2,2-hexolate; 2-nonylphenolate Openeye Name: heptastrontium; ethane-1,1,1,2,2,2-hexolate; 2-nonylphenolate CAS Name: heptastrontium; ethane-1,1,1,2,2,2-hexolate; 2-nonylphenolate IUPAC Name: heptastrontium; ethane-1,1,1,2,2,2-hexolate; 2-nonylphenolate Traditional Name: heptastrontium; ethane-1,1,1,2,2,2-hexolate; 2-nonylphenolate Formula: C34H46O14Sr7 MolecularWeight: 1292.06064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC=C1[O-].CCCCCCCCCC1=CC=CC=C1[O-].C(C([O-])([O-])[O-])([O-])([O-])[O-].C(C([O-])([O-])[O-])([O-])([O-])[O-].[Sr+2].[Sr+2].[Sr+2].[Sr+2].[Sr+2].[Sr+2].[Sr+2]

Isomeric SMILES

CCCCCCCCCC1=CC=CC=C1[O-].CCCCCCCCCC1=CC=CC=C1[O-].C(C([O-])([O-])[O-])([O-])([O-])[O-].C(C([O-])([O-])[O-])([O-])([O-])[O-].[Sr+2].[Sr+2].[Sr+2].[Sr+2].[Sr+2].[Sr+2].[Sr+2]

InChI

InChI=1S/2C15H24O.2C2O6.7Sr/c2*1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16;2*3-1(4,5)2(6,7)8;;;;;;;/h2*9-10,12-13,16H,2-8,11H2,1H3;;;;;;;;;/q;;2*-6;7*+2/p-2