2,2-bis[(4-isocyanato-3-methyl-phenyl)carbamoyloxymethyl]butyl N-(4-isocyanato-3-methyl-phenyl)carbamate

Systemtic Name: 2,2-bis[(4-isocyanato-3-methyl-phenyl)carbamoyloxymethyl]butyl N-(4-isocyanato-3-methyl-phenyl)carbamate Openeye Name: 2,2-bis[(4-isocyanato-3-methyl-phenyl)carbamoyloxymethyl]butyl N-(4-isocyanato-3-methyl-phenyl)carbamate CAS Name: N-(4-isocyanato-3-methylphenyl)carbamic acid 2,2-bis[[(4-isocyanato-3-methylanilino)-oxomethoxy]methyl]butyl ester IUPAC Name: 2,2-bis[(4-isocyanato-3-methylphenyl)carbamoyloxymethyl]butyl N-(4-isocyanato-3-methylphenyl)carbamate Traditional Name: N-(4-isocyanato-3-methyl-phenyl)carbamic acid 2,2-bis[(4-isocyanato-3-methyl-phenyl)carbamoyloxymethyl]butyl ester Formula: C33H32N6O9 MolecularWeight: 656.64198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)NC1=CC(=C(C=C1)N=C=O)C)(COC(=O)NC2=CC(=C(C=C2)N=C=O)C)COC(=O)NC3=CC(=C(C=C3)N=C=O)C

Isomeric SMILES

CCC(COC(=O)NC1=CC(=C(C=C1)N=C=O)C)(COC(=O)NC2=CC(=C(C=C2)N=C=O)C)COC(=O)NC3=CC(=C(C=C3)N=C=O)C

InChI

InChI=1S/C33H32N6O9/c1-5-33(15-46-30(43)37-24-6-9-27(34-18-40)21(2)12-24,16-47-31(44)38-25-7-10-28(35-19-41)22(3)13-25)17-48-32(45)39-26-8-11-29(36-20-42)23(4)14-26/h6-14H,5,15-17H2,1-4H3,(H,37,43)(H,38,44)(H,39,45)