Xanthoascin
[CAS# 61391-08-0]

Identification

• Name: Xanthoascin
• Synonyms: 4-[(1Z,3Z)-4-(2,2-Dimethylchroman-6-Yl)-2,3-Diisocyano-Buta-1,3-Dienyl]Phenol; 4-[(1Z,3Z)-4-(2,2-Dimethyl-6-Chromanyl)-2,3-Diisocyanobuta-1,3-Dienyl]Phenol; Phenol, 4-(4-(3,4-Dihydro-2,2-Dimethyl-2H-1-Benzopyran-6-Yl)-2,3-Diisocyano-1,3-Butadienyl)-
• Molecular Formula: C₂₃H₂₀N₂O₂
• Molecular Weight: 356.42
• CAS Registry Number: 61391-08-0
• SMILES: C1=C3C(=CC=C1/C=C([N+]#[C-])/C([N+]#[C-])=C/C2=CC=C(O)C=C2)OC(CC3)(C)C
• InChI: 1S/C23H20N2O2/c1-23(2)12-11-18-13-17(7-10-22(18)27-23)15-21(25-4)20(24-3)14-16-5-8-19(26)9-6-16/h5-10,13-15,26H,11-12H2,1-2H3/b20-14-,21-15-
• InChIKey: ONZXHWTZPHRYLC-SIBCGJTDSA-N