(1E,4Z)-3-ethyl-1-isocyanato-7-[(6-isocyanatocyclohepta-2,5-dien-1-yl)methyl]cycloocta-1,4-diene

Systemtic Name: (1E,4Z)-3-ethyl-1-isocyanato-7-[(6-isocyanatocyclohepta-2,5-dien-1-yl)methyl]cycloocta-1,4-diene Openeye Name: (1E,4Z)-3-ethyl-1-isocyanato-7-[(6-isocyanatocyclohepta-2,5-dien-1-yl)methyl]cycloocta-1,4-diene CAS Name: (1E,4Z)-3-ethyl-1-isocyanato-7-[(6-isocyanato-1-cyclohepta-2,5-dienyl)methyl]cycloocta-1,4-diene IUPAC Name: (1E,4Z)-3-ethyl-1-isocyanato-7-[(6-isocyanatocyclohepta-2,5-dien-1-yl)methyl]cycloocta-1,4-diene Traditional Name: (1E,4Z)-3-ethyl-1-isocyanato-7-[(6-isocyanatocyclohepta-2,5-dien-1-yl)methyl]cycloocta-1,4-diene Formula: C20H24N2O2 MolecularWeight: 324.41676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C=CCC(CC(=C1)N=C=O)CC2CC(=CCC=C2)N=C=O

Isomeric SMILES

CCC/1/C=C\CC(C/C(=C1)/N=C=O)CC2CC(=CCC=C2)N=C=O

InChI

InChI=1S/C20H24N2O2/c1-2-16-7-5-8-18(13-20(11-16)22-15-24)10-17-6-3-4-9-19(12-17)21-14-23/h3,5-7,9,11,16-18H,2,4,8,10,12-13H2,1H3/b7-5-,20-11+