zinc 8-(octylsulfonylamino)quinoline-2-carboxylate

Systemtic Name: zinc 8-(octylsulfonylamino)quinoline-2-carboxylate Openeye Name: zinc 8-(octylsulfonylamino)quinoline-2-carboxylate CAS Name: zinc 8-(octylsulfonylamino)-2-quinolinecarboxylate IUPAC Name: zinc 8-(octylsulfonylamino)quinoline-2-carboxylate Traditional Name: zinc 8-(octylsulfonylamino)quinaldate Formula: C36H46N4O8S2Zn MolecularWeight: 792.31144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)NC1=CC=CC2=C1N=C(C=C2)C(=O)[O-].CCCCCCCCS(=O)(=O)NC1=CC=CC2=C1N=C(C=C2)C(=O)[O-].[Zn+2]

Isomeric SMILES

CCCCCCCCS(=O)(=O)NC1=CC=CC2=C1N=C(C=C2)C(=O)[O-].CCCCCCCCS(=O)(=O)NC1=CC=CC2=C1N=C(C=C2)C(=O)[O-].[Zn+2]

InChI

InChI=1S/2C18H24N2O4S.Zn/c2*1-2-3-4-5-6-7-13-25(23,24)20-15-10-8-9-14-11-12-16(18(21)22)19-17(14)15;/h2*8-12,20H,2-7,13H2,1H3,(H,21,22);/q;;+2/p-2