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81721-80-4 | 6-BENZYL-5H-INDENO[1,2-C]ISOQUINOLINE-5,11(6H)-DIONE
CAS No: 81721-80-4 Catalog No: AG0057RC MDL No:
Product Description
Catalog Number:
AG0057RC
Chemical Name:
6-BENZYL-5H-INDENO[1,2-C]ISOQUINOLINE-5,11(6H)-DIONE
CAS Number:
81721-80-4
Molecular Formula:
C23H15NO2
Molecular Weight:
337.3707
IUPAC Name:
6-benzylindeno[1,2-c]isoquinoline-5,11-dione
InChI:
InChI=1S/C23H15NO2/c25-22-18-12-6-5-11-17(18)21-20(22)16-10-4-7-13-19(16)23(26)24(21)14-15-8-2-1-3-9-15/h1-13H,14H2
InChI Key:
CVVPLIBSSHGDNT-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2c2c1c1ccccc1c(=O)n2Cc1ccccc1
NSC Number:
337612
Properties
Complexity:
630
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.11g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.378g/mol
Monoisotopic Mass:
337.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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