2-(9-oxidanylidenethioxanthen-2-yl)oxyethyl N-(6-isocyanatohexyl)carbamate

Systemtic Name: 2-(9-oxidanylidenethioxanthen-2-yl)oxyethyl N-(6-isocyanatohexyl)carbamate Openeye Name: 2-(9-oxothioxanthen-2-yl)oxyethyl N-(6-isocyanatohexyl)carbamate CAS Name: N-(6-isocyanatohexyl)carbamic acid 2-[(9-oxo-2-thioxanthenyl)oxy]ethyl ester IUPAC Name: 2-(9-oxothioxanthen-2-yl)oxyethyl N-(6-isocyanatohexyl)carbamate Traditional Name: N-(6-isocyanatohexyl)carbamic acid 2-(9-ketothioxanthen-2-yl)oxyethyl ester Formula: C23H24N2O5S MolecularWeight: 440.51206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(S2)C=CC(=C3)OCCOC(=O)NCCCCCCN=C=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2)C=CC(=C3)OCCOC(=O)NCCCCCCN=C=O

InChI

InChI=1S/C23H24N2O5S/c26-16-24-11-5-1-2-6-12-25-23(28)30-14-13-29-17-9-10-21-19(15-17)22(27)18-7-3-4-8-20(18)31-21/h3-4,7-10,15H,1-2,5-6,11-14H2,(H,25,28)