Chemical ID: 7703634

CCOc1cc(ccc1C(=O)Nc2cc(cc(c2)C(=O)O)C(=O)O)Cl
Chemical ID:
7703634
Name [?]:
None
SMILES [?]:
CCOc1cc(ccc1C(=O)Nc2cc(cc(c2)C(=O)O)C(=O)O)Cl
InChi [?]:
InChI=1/C17H14ClNO6/c1-2-25-14-8-11(18)3-4-13(14)15(20)19-12-6-9(16(21)22)5-10(7-12)17(23)24/h3-8H,2H2,1H3,(H,19,20)(H,21,22)(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,2,7,8,16,14,18,5,15,17,6,13,9,4,10,22,19,25,12,11,23,24,20,21,3/E:(6,7)(9,10)(16,17)(21,22,23,24)/gE:(2,3)/rA:25nCCOCCCCCCCONCCCCCCCOOCOOCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s17;d19;s19;s15;d22;s22;s6;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14ClNO6
All Atoms:39
Heavy Atoms:25
Chiral Atoms:None
ZAP Information [?]
Total:8.85632
Area:574.29
Solvation:-5.50094
Coulombic:-81.6419
Bond Count [?]
All:26
Single:17
Double:9
Rotors:7
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.18
LogP (Chemaxon):None

Name Annotations

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Descriptor Annotations

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