phthalate; trioctylstannanylium

Systemtic Name: phthalate; trioctylstannanylium Openeye Name: phthalate; trioctylstannanylium CAS Name: phthalate; trioctylstannanylium IUPAC Name: phthalate; trioctylstannanylium Traditional Name: phthalate; trioctylstannanylium Formula: C56H106O4Sn2 MolecularWeight: 1080.85844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn+](CCCCCCCC)CCCCCCCC.CCCCCCCC[Sn+](CCCCCCCC)CCCCCCCC.C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCCCCC[Sn+](CCCCCCCC)CCCCCCCC.CCCCCCCC[Sn+](CCCCCCCC)CCCCCCCC.C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C8H6O4.6C8H17.2Sn/c9-7(10)5-3-1-2-4-6(5)8(11)12;6*1-3-5-7-8-6-4-2;;/h1-4H,(H,9,10)(H,11,12);6*1,3-8H2,2H3;;/q;;;;;;;2*+1/p-2