Chemical ID: 7352429

COc1ccc2c(c1)c3c([nH]2)CCN(C3)C(=O)c4ccccc4
Chemical ID:
7352429
Name [?]:
None
SMILES [?]:
COc1ccc2c(c1)c3c([nH]2)CCN(C3)C(=O)c4ccccc4
InChi [?]:
InChI=1/C19H18N2O2/c1-23-14-7-8-17-15(11-14)16-12-21(10-9-18(16)20-17)19(22)13-5-3-2-4-6-13/h2-8,11,20H,9-10,12H2,1H3
InChi Info:
AuxInfo=1/0/N:1,21,20,22,19,23,4,5,12,13,8,15,18,3,7,9,6,10,16,11,14,17,2/E:(3,4)(5,6)/rA:23nCOCCCCCCCCNCCNCCOCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;d9;s6s10;s10;s12;s13;s9s14;s14;d16;s16;s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N2O2
All Atoms:41
Heavy Atoms:23
Chiral Atoms:None
ZAP Information [?]
Total:8.82562
Area:491.932
Solvation:-3.47267
Coulombic:-36.2793
Bond Count [?]
All:26
Single:18
Double:8
Rotors:3
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.12
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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