diphenyltin(2+); (Z)-2-octylbut-2-enedioate

Systemtic Name: diphenyltin(2+); (Z)-2-octylbut-2-enedioate Openeye Name: diphenyltin(2+); (Z)-2-octylbut-2-enedioate CAS Name: diphenyltin(2+); (Z)-2-octyl-2-butenedioate IUPAC Name: diphenyltin(2+); (Z)-2-octylbut-2-enedioate Traditional Name: diphenyltin(2+); (Z)-2-octylbut-2-enedioate Formula: C48H56O8Sn2 MolecularWeight: 998.37344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=CC(=O)[O-])C(=O)[O-].CCCCCCCCC(=CC(=O)[O-])C(=O)[O-].C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2.C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2

Isomeric SMILES

CCCCCCCC/C(=C/C(=O)[O-])/C(=O)[O-].CCCCCCCC/C(=C/C(=O)[O-])/C(=O)[O-].C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2.C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2

InChI

InChI=1S/2C12H20O4.4C6H5.2Sn/c2*1-2-3-4-5-6-7-8-10(12(15)16)9-11(13)14;4*1-2-4-6-5-3-1;;/h2*9H,2-8H2,1H3,(H,13,14)(H,15,16);4*1-5H;;/q;;;;;;2*+2/p-4/b2*10-9-;;;;;;