1-[(1E,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-hexoxy-benzene

Systemtic Name: 1-[(1E,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-hexoxy-benzene Openeye Name: 1-[(1E,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-hexoxy-benzene CAS Name: 1-[(1E,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-hexoxybenzene IUPAC Name: 1-[(1E,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-hexoxybenzene Traditional Name: 1-[(1E,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-hexoxy-benzene Formula: C25H26N2O2 MolecularWeight: 386.48614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=C(C(=CC2=CC=C(C=C2)OC)[N+]#[C-])[N+]#[C-]

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)/C=C(\C(=C\C2=CC=C(C=C2)OC)\[N+]#[C-])/[N+]#[C-]

InChI

InChI=1S/C25H26N2O2/c1-5-6-7-8-17-29-23-15-11-21(12-16-23)19-25(27-3)24(26-2)18-20-9-13-22(28-4)14-10-20/h9-16,18-19H,5-8,17H2,1,4H3/b24-18-,25-19+