Chemical ID: 4271317

CC(=O)Nc1ccc2c(c1)C(=O)c3ccccc3C2=O
Chemical ID:
4271317
Name [?]:
N-(9,10-dioxo-2-anthryl)acetamide
SMILES [?]:
CC(=O)Nc1ccc2c(c1)C(=O)c3ccccc3C2=O
InChi [?]:
InChI=1/C16H11NO3/c1-9(18)17-10-6-7-13-14(8-10)16(20)12-5-3-2-4-11(12)15(13)19/h2-8H,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,16,15,17,14,6,7,10,2,5,18,13,8,9,19,11,4,3,20,12/rA:20nCCONCCCCCCCOCCCCCCCO/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s9;d11;s11;s13;d14;s15;d16;d13s17;s8s18;d19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H11NO3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.49218
Area:437.572
Solvation:-3.44713
Coulombic:-36.4473
Bond Count [?]
All:22
Single:13
Double:9
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:265.263
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.36
LogP (Chemaxon):1.77

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