(1Z)-1-[5-decyl-2-(9-isocyanatononyl)-6-pentyl-cyclohex-3-en-1-yl]-11-isocyanato-cycloundecene

Systemtic Name: (1Z)-1-[5-decyl-2-(9-isocyanatononyl)-6-pentyl-cyclohex-3-en-1-yl]-11-isocyanato-cycloundecene Openeye Name: (1Z)-1-[5-decyl-2-(9-isocyanatononyl)-6-pentyl-cyclohex-3-en-1-yl]-11-isocyanato-cycloundecene CAS Name: (1Z)-1-[5-decyl-2-(9-isocyanatononyl)-6-pentyl-1-cyclohex-3-enyl]-11-isocyanatocycloundecene IUPAC Name: (1Z)-1-[5-decyl-2-(9-isocyanatononyl)-6-pentylcyclohex-3-en-1-yl]-11-isocyanatocycloundecene Traditional Name: (1Z)-1-[6-amyl-5-decyl-2-(9-isocyanatononyl)cyclohex-3-en-1-yl]-11-isocyanato-cycloundecene Formula: C43H74N2O2 MolecularWeight: 651.05986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1C=CC(C(C1CCCCC)C2=CCCCCCCCCC2N=C=O)CCCCCCCCCN=C=O

Isomeric SMILES

CCCCCCCCCCC1C=CC(C(C1CCCCC)/C/2=C/CCCCCCCCC2N=C=O)CCCCCCCCCN=C=O

InChI

InChI=1S/C43H74N2O2/c1-3-5-7-8-9-12-17-23-28-38-33-34-39(29-24-18-13-11-16-21-27-35-44-36-46)43(40(38)30-22-6-4-2)41-31-25-19-14-10-15-20-26-32-42(41)45-37-47/h31,33-34,38-40,42-43H,3-30,32,35H2,1-2H3/b41-31+