butane; 1-isocyano-4-(4-isocyanophenoxy)benzene

Systemtic Name: butane; 1-isocyano-4-(4-isocyanophenoxy)benzene Openeye Name: butane; 1-isocyano-4-(4-isocyanophenoxy)benzene CAS Name: butane; 1-isocyano-4-(4-isocyanophenoxy)benzene IUPAC Name: butane; 1-isocyano-4-(4-isocyanophenoxy)benzene Traditional Name: 1-isocyano-4-(4-isocyanophenoxy)benzene; n-butane Formula: C18H18N2O MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.[C-]#[N+]C1=CC=C(C=C1)OC2=CC=C(C=C2)[N+]#[C-]

Isomeric SMILES

CCCC.[C-]#[N+]C1=CC=C(C=C1)OC2=CC=C(C=C2)[N+]#[C-]

InChI

InChI=1S/C14H8N2O.C4H10/c1-15-11-3-7-13(8-4-11)17-14-9-5-12(16-2)6-10-14;1-3-4-2/h3-10H;3-4H2,1-2H3