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846-66-2 | 2H-Benzo[a]quinolizin-2-one,3-ethyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-
CAS No: 846-66-2 Catalog No: AG008H00 MDL No:
Product Description
Catalog Number:
AG008H00
Chemical Name:
2H-Benzo[a]quinolizin-2-one,3-ethyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-
CAS Number:
846-66-2
Molecular Formula:
C17H23NO3
Molecular Weight:
289.3694
IUPAC Name:
3-ethyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-one
InChI:
InChI=1S/C17H23NO3/c1-4-11-10-18-6-5-12-7-16(20-2)17(21-3)8-13(12)14(18)9-15(11)19/h7-8,11,14H,4-6,9-10H2,1-3H3
InChI Key:
BOBCQOOZINHVMK-UHFFFAOYSA-N
SMILES:
CCC1CN2CCc3c(C2CC1=O)cc(c(c3)OC)OC
NSC Number:
49007
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.168g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.375g/mol
Monoisotopic Mass:
289.168g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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