AC1NKI95 structure

AC1NKI95

methyl 2-[9-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-2-oxo-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-3-yl]acetate

Also Known As: methyl 2-(9-(3,4-dimethoxyphenethyl)-4-methyl-2-oxo-2,8,9,10-tetrahydrochromeno[8,7-e][1,3]oxazin-3-yl)acetate|methyl {9-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-2-oxo-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl}acetate|methyl 2-[9-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-2-oxo-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-3-yl]acetate|METHYL 2-{9-[2-(3,4-DIMETHOXYPHENYL)ETHYL]-4-METHYL-2-OXO-2H,8H,9H,10H-CHROMENO[8,7-E][1,3]OXAZIN-3-YL}ACETATE|methyl 2-{9-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-2-oxo-8H,10H-chromeno[8,7- e]1,3-oxazaperhydroin-3-yl}acetate

CAS: 853893-76-2
Molecular Formula C25H27NO7
Molecular Weight 453.17874 g/mol
LogP 3.22872
Topological Polar Surface Area 87.44 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 7
Exact Mass 453.17874
Monoisotopic Mass 453.17874
Heavy Atoms 33
Complexity 1247.7145

Chemical Identifiers

CAS Number 853893-76-2
SMILES CC1=C(C(=O)OC2=C1C=CC3=C2CN(CO3)CCC4=CC(=C(C=C4)OC)OC)CC(=O)OC

Product Overview

AC1NKI95 (CAS 853893-76-2), with molecular formula C25H27NO7 and molecular weight 453.17874 g/mol. IUPAC: methyl 2-[9-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-2-oxo-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-3-yl]acetate.

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