194282-76-3
2-AMINO-4-(4-METHOXYPHENYL)-7-METHYL-5-OXO-4H,5H-PYRANO[4,3-B]PYRAN-3-CARBONITRILE
Name2-AMINO-4-(4-METHOXYPHENYL)-7-METHYL-5-OXO-4H,5H-PYRANO[4,3-B]PYRAN-3-CARBONITRILE
1Identification
【Name】
2-AMINO-4-(4-METHOXYPHENYL)-7-METHYL-5-OXO-4H,5H-PYRANO[4,3-B]PYRAN-3-CARBONITRILE
【CAS】
【MDL】
MFCD00544249
【English Synonyms】
【Formula】
C17 H14 N2 O4
【MolWeight】
310.308
【Inchi】
InChI=1S/C17H14N2O4/c1-9-7-13-15(17(20)22-9)14(12(8-18)16(19)23-13)10-3-5-11(21-2)6-4-10/h3-7,14H,19H2,1-2H3
【InChIKey】
InChIKey=AMRKTUNAOZHNMU-UHFFFAOYSA-N
【SMILES】
Cc1cc2c(c(=O)o1)C(C(=C(O2)N)C#N)c3ccc(cc3)OC
【MOL File】
2-AMINO-4-(4-METHOXY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-AMINO-4-(4-METHOXYPHENYL)-7-METHYL-5-OXO-4H,5H-PYRANO[4,3-B]PYRAN-3-CARBONITRILE.cml