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209113-90-6 | Quinoline, 3-chloro-6-methoxy-4-[2-(1-methyl-4-piperidinyl)ethyl]-, hydrochloride (1:?)
CAS No: 209113-90-6 Catalog No: AG002K21 MDL No:
Product Description
Catalog Number:
AG002K21
Chemical Name:
Quinoline, 3-chloro-6-methoxy-4-[2-(1-methyl-4-piperidinyl)ethyl]-, hydrochloride (1:?)
CAS Number:
209113-90-6
Molecular Formula:
C18H24Cl2N2O
Molecular Weight:
355.3020
IUPAC Name:
3-chloro-6-methoxy-4-[2-(1-methylpiperidin-4-yl)ethyl]quinoline;hydrochloride
InChI:
InChI=1S/C18H23ClN2O.ClH/c1-21-9-7-13(8-10-21)3-5-15-16-11-14(22-2)4-6-18(16)20-12-17(15)19;/h4,6,11-13H,3,5,7-10H2,1-2H3;1H
InChI Key:
LFLFDHQZNQTGLI-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(CCC1CCN(CC1)C)c(cn2)Cl.Cl
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.127g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
355.303g/mol
Monoisotopic Mass:
354.127g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
25.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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