2-ethenyl-1,3-diisocyanato-benzene; 1-ethenyl-4-isocyanato-benzene; 2-isocyanatobut-1-ene; 3-isocyanatobut-1-ene; 3-isocyanatoprop-1-ene

Systemtic Name: 2-ethenyl-1,3-diisocyanato-benzene; 1-ethenyl-4-isocyanato-benzene; 2-isocyanatobut-1-ene; 3-isocyanatobut-1-ene; 3-isocyanatoprop-1-ene Openeye Name: 1,3-diisocyanato-2-vinyl-benzene; 2-isocyanatobut-1-ene; 3-isocyanatobut-1-ene; 3-isocyanatoprop-1-ene; 1-isocyanato-4-vinyl-benzene CAS Name: 2-ethenyl-1,3-diisocyanatobenzene; 1-ethenyl-4-isocyanatobenzene; 2-isocyanato-1-butene; 3-isocyanato-1-butene; 3-isocyanato-1-propene IUPAC Name: 2-ethenyl-1,3-diisocyanatobenzene; 1-ethenyl-4-isocyanatobenzene; 2-isocyanatobut-1-ene; 3-isocyanatobut-1-ene; 3-isocyanatoprop-1-ene Traditional Name: 1,3-diisocyanato-2-vinyl-benzene; 2-isocyanatobut-1-ene; 3-isocyanatobut-1-ene; 3-isocyanatoprop-1-ene; 1-isocyanato-4-vinyl-benzene Formula: C33H32N6O6 MolecularWeight: 608.64378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)N=C=O.CC(C=C)N=C=O.C=CCN=C=O.C=CC1=CC=C(C=C1)N=C=O.C=CC1=C(C=CC=C1N=C=O)N=C=O

Isomeric SMILES

CCC(=C)N=C=O.CC(C=C)N=C=O.C=CCN=C=O.C=CC1=CC=C(C=C1)N=C=O.C=CC1=C(C=CC=C1N=C=O)N=C=O

InChI

InChI=1S/C10H6N2O2.C9H7NO.2C5H7NO.C4H5NO/c1-2-8-9(11-6-13)4-3-5-10(8)12-7-14;1-2-8-3-5-9(6-4-8)10-7-11;2*1-3-5(2)6-4-7;1-2-3-5-4-6/h2-5H,1H2;2-6H,1H2;2-3H2,1H3;3,5H,1H2,2H3;2H,1,3H2