Identification
Name |
Xanthocillin X Monomethyl Ether |
Synonyms |
Brn 4332417; Ethylene Isocyanide, (P-Hydroxybenzylidene)(P-Methoxybenzylidine)-; Phenol, 4-(2,3-Diisocyano-4-(4-Methoxyphenyl)-1,3-Butadienyl)- (9Ci) |
|
Molecular Structure |
 |
Molecular Formula |
C19H14N2O2 |
Molecular Weight |
302.33 |
CAS Registry Number |
19559-24-1 |
SMILES |
C2=C(/C=C([N+]#[C-])/C([N+]#[C-])=C/C1=CC=C(O)C=C1)C=CC(=C2)OC |
InChI |
1S/C19H14N2O2/c1-20-18(12-14-4-8-16(22)9-5-14)19(21-2)13-15-6-10-17(23-3)11-7-15/h4-13,22H,3H3/b18-12-,19-13- |
InChIKey |
NIFGBMKUAMIQJA-BKHHGCLFSA-N |
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