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Home > Indoles and Oxindole > 82349-15-3
82349-15-3 | 1,3-Dihydro-3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-2H-indol-2-one 2-oxime
CAS No: 82349-15-3 Catalog No: AG00541B MDL No:
Product Description
Catalog Number:
AG00541B
Chemical Name:
1,3-Dihydro-3-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-2H-indol-2-one 2-oxime
CAS Number:
82349-15-3
Molecular Formula:
C16H11N3O2
Molecular Weight:
277.2774
IUPAC Name:
2-(2-nitroso-1H-indol-3-yl)-1H-indol-3-ol
InChI:
InChI=1S/C16H11N3O2/c20-15-10-6-2-4-8-12(10)17-14(15)13-9-5-1-3-7-11(9)18-16(13)19-21/h1-8,17-18,20H
InChI Key:
ZRFSLJVBJSMYTG-UHFFFAOYSA-N
SMILES:
ON=C1Nc2c(C1=C1Nc3c(C1=O)cccc3)cccc2
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.085g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
277.283g/mol
Monoisotopic Mass:
277.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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