phthalate; triphenylstannanylium

Systemtic Name: phthalate; triphenylstannanylium Openeye Name: phthalate; triphenylstannanylium CAS Name: phthalate; triphenylstannanylium IUPAC Name: phthalate; triphenylstannanylium Traditional Name: phthalate; triphenylstannanylium Formula: C44H34O4Sn2 MolecularWeight: 864.15836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C8H6O4.6C6H5.2Sn/c9-7(10)5-3-1-2-4-6(5)8(11)12;6*1-2-4-6-5-3-1;;/h1-4H,(H,9,10)(H,11,12);6*1-5H;;/q;;;;;;;2*+1/p-2