butane-1,1-diol; 1,3-diisocyanatobenzene

Systemtic Name: butane-1,1-diol; 1,3-diisocyanatobenzene Openeye Name: butane-1,1-diol; 1,3-diisocyanatobenzene CAS Name: butane-1,1-diol; 1,3-diisocyanatobenzene IUPAC Name: butane-1,1-diol; 1,3-diisocyanatobenzene Traditional Name: butane-1,1-diol; 1,3-diisocyanatobenzene Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(O)O.C1=CC(=CC(=C1)N=C=O)N=C=O

Isomeric SMILES

CCCC(O)O.C1=CC(=CC(=C1)N=C=O)N=C=O

InChI

InChI=1S/C8H4N2O2.C4H10O2/c11-5-9-7-2-1-3-8(4-7)10-6-12;1-2-3-4(5)6/h1-4H;4-6H,2-3H2,1H3