1-isocyanato-4-(4-isocyanato-3-methyl-phenyl)-2-methyl-benzene; oxirane; oxolane

Systemtic Name: 1-isocyanato-4-(4-isocyanato-3-methyl-phenyl)-2-methyl-benzene; oxirane; oxolane Openeye Name: 1-isocyanato-4-(4-isocyanato-3-methyl-phenyl)-2-methyl-benzene; oxirane; tetrahydrofuran CAS Name: 1-isocyanato-4-(4-isocyanato-3-methylphenyl)-2-methylbenzene; oxirane; oxolane IUPAC Name: 1-isocyanato-4-(4-isocyanato-3-methylphenyl)-2-methylbenzene; oxirane; oxolane Traditional Name: ethylene oxide; 1-isocyanato-4-(4-isocyanato-3-methyl-phenyl)-2-methyl-benzene; tetrahydrofuran Formula: C22H24N2O4 MolecularWeight: 380.43696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=C=O)C)N=C=O.C1CCOC1.C1CO1

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=C=O)C)N=C=O.C1CCOC1.C1CO1

InChI

InChI=1S/C16H12N2O2.C4H8O.C2H4O/c1-11-7-13(3-5-15(11)17-9-19)14-4-6-16(18-10-20)12(2)8-14;1-2-4-5-3-1;1-2-3-1/h3-8H,1-2H3;1-4H2;1-2H2