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Home > Indoles and Oxindole > 116618-53-2
116618-53-2 | 11H-Indolo[3,2-c]quinoline, 8-methoxy-11-methyl-, 5-oxide
CAS No: 116618-53-2 Catalog No: AG000CWK MDL No:
Product Description
Catalog Number:
AG000CWK
Chemical Name:
11H-Indolo[3,2-c]quinoline, 8-methoxy-11-methyl-, 5-oxide
CAS Number:
116618-53-2
Molecular Formula:
C17H14N2O2
Molecular Weight:
278.3053
IUPAC Name:
8-methoxy-11-methyl-5-oxidoindolo[3,2-c]quinolin-5-ium
InChI:
InChI=1S/C17H14N2O2/c1-18-15-8-7-11(21-2)9-13(15)14-10-19(20)16-6-4-3-5-12(16)17(14)18/h3-10H,1-2H3
InChI Key:
RBMQSDGHXXNMDA-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c1c[n+]([O-])c3c(c1n2C)cccc3
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.106g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.311g/mol
Monoisotopic Mass:
278.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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