Chemical ID: 6147341

c1ccc(cc1)c2cc(=[NH+]Cc3ccco3)c4cc(ccc4o2)Cl
Chemical ID:
6147341
Name [?]:
(6-chloro-2-phenyl-chromen-4-ylidene)-(2-furylmethyl)ammonium
SMILES [?]:
c1ccc(cc1)c2cc(=[NH+]Cc3ccco3)c4cc(ccc4o2)Cl
InChi [?]:
InChI=1/C20H14ClNO2/c21-15-8-9-19-17(11-15)18(22-13-16-7-4-10-23-16)12-20(24-19)14-5-2-1-3-6-14/h1-12H,13H2/p+1
InChi Info:
AuxInfo=1/1/N:1,2,6,14,3,5,13,20,21,15,18,8,11,4,19,12,17,9,22,7,24,10,16,23/E:(2,3)(5,6)/rA:24nCCCCCCCCCN+CCCCCOCCCCCCOCl/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;w9;s10;s11;d12;s13;d14;s12s15;s9;s17;d18;s19;d20;d17s21;s7s22;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H15ClNO2+
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:-20.501
Area:542.069
Solvation:-34.0528
Coulombic:-5.11689
Bond Count [?]
All:27
Single:17
Double:10
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:336.791
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.92
LogP (Chemaxon):5.28

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