Chemical ID: 4932137

c1ccc(cc1)C=c2cc-3oc(=O)c4c3c(c2=O)ccc4
Chemical ID:
4932137
Name [?]:
None
SMILES [?]:
c1ccc(cc1)C=c2cc-3oc(=O)c4c3c(c2=O)ccc4
InChi [?]:
InChI=1/C18H10O3/c19-17-12(9-11-5-2-1-3-6-11)10-15-16-13(17)7-4-8-14(16)18(20)21-15/h1-10H
InChi Info:
AuxInfo=1/0/N:1,2,6,20,3,5,19,21,7,9,4,8,16,14,10,15,17,12,18,13,11/E:(2,3)(5,6)/rA:21nCCCCCCCCCCOCOCCCCOCCC/rB:s1;d2;s3;d4;d1s5;s4;w7;s8;d9;s10;s11;d12;s12;s10s14;d15;s8s16;d17;s16;d19;d14s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H10O3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:8.48048
Area:448.625
Solvation:-2.73514
Coulombic:-29.3663
Bond Count [?]
All:24
Single:14
Double:10
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:274.27
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.76
LogP (Chemaxon):3.58

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Descriptor Annotations

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