molybdenum; N-[(E)-octadec-9-enyl]carbamothioate

Systemtic Name: molybdenum; N-[(E)-octadec-9-enyl]carbamothioate Openeye Name: molybdenum; N-[(E)-octadec-9-enyl]carbamothioate CAS Name: molybdenum; N-[(E)-octadec-9-enyl]carbamothioate IUPAC Name: molybdenum; N-[(E)-octadec-9-enyl]carbamothioate Traditional Name: molybdenum; N-[(E)-octadec-9-enyl]thiocarbamate Formula: C114H216MoN6O6S6-6 MolecularWeight: 2055.30144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCNC(=S)[O-].CCCCCCCCC=CCCCCCCCCNC(=S)[O-].CCCCCCCCC=CCCCCCCCCNC(=S)[O-].CCCCCCCCC=CCCCCCCCCNC(=S)[O-].CCCCCCCCC=CCCCCCCCCNC(=S)[O-].CCCCCCCCC=CCCCCCCCCNC(=S)[O-].[Mo]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCNC(=S)[O-].CCCCCCCC/C=C/CCCCCCCCNC(=S)[O-].CCCCCCCC/C=C/CCCCCCCCNC(=S)[O-].CCCCCCCC/C=C/CCCCCCCCNC(=S)[O-].CCCCCCCC/C=C/CCCCCCCCNC(=S)[O-].CCCCCCCC/C=C/CCCCCCCCNC(=S)[O-].[Mo]

InChI

InChI=1S/6C19H37NOS.Mo/c6*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19(21)22;/h6*9-10H,2-8,11-18H2,1H3,(H2,20,21,22);/p-6/b6*10-9+;