Chemical ID: 7715247

c1ccc(cc1)CCc2cc(=O)cc([nH]2)c3ccccc3
Chemical ID:
7715247
Name [?]:
None
SMILES [?]:
c1ccc(cc1)CCc2cc(=O)cc([nH]2)c3ccccc3
InChi [?]:
InChI=1/C19H17NO/c21-18-13-17(12-11-15-7-3-1-4-8-15)20-19(14-18)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,19,2,6,18,20,3,5,17,21,7,8,10,13,4,16,9,11,14,15,12/E:(3,4)(5,6)(7,8)(9,10)/rA:21nCCCCCCCCCCCOCCNCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;d11;s11;d13;s9s14;s14;s16;d17;s18;d19;d16s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H17NO
All Atoms:38
Heavy Atoms:21
Chiral Atoms:None
ZAP Information [?]
Total:10.1896
Area:498.682
Solvation:-2.27747
Coulombic:-22.1827
Bond Count [?]
All:23
Single:14
Double:9
Rotors:4
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.32
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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