dioctyl-bis(2,4,6-trinitrophenoxy)stannane

Systemtic Name: dioctyl-bis(2,4,6-trinitrophenoxy)stannane Openeye Name: dioctyl-bis(2,4,6-trinitrophenoxy)stannane CAS Name: dioctyl-bis(2,4,6-trinitrophenoxy)stannane IUPAC Name: dioctyl-bis(2,4,6-trinitrophenoxy)stannane Traditional Name: dioctyl-bis(2,4,6-trinitrophenoxy)stannane Formula: C28H38N6O14Sn MolecularWeight: 801.34312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn](CCCCCCCC)(OC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])OC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCC[Sn](CCCCCCCC)(OC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])OC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/2C8H17.2C6H3N3O7.Sn/c2*1-3-5-7-8-6-4-2;2*10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;/h2*1,3-8H2,2H3;2*1-2,10H;/q;;;;+2/p-2