Chemical ID: 6760872

CC(=O)Oc1ccc(cc1)N=c2cc(oc3c2cc(cc3)Cl)c4ccccc4
Chemical ID:
6760872
Name [?]:
[4-(6-chloro-2-phenyl-chromen-4-ylidene)aminophenyl] acetate
SMILES [?]:
CC(=O)Oc1ccc(cc1)N=c2cc(oc3c2cc(cc3)Cl)c4ccccc4
InChi [?]:
InChI=1/C23H16ClNO3/c1-15(26)27-19-10-8-18(9-11-19)25-21-14-23(16-5-3-2-4-6-16)28-22-12-7-17(24)13-20(21)22/h2-14H,1H3
InChi Info:
AuxInfo=1/0/N:1,26,25,27,24,28,20,7,9,6,10,21,18,13,2,23,19,8,5,17,12,16,14,22,11,3,4,15/E:(3,4)(5,6)(8,9)(10,11)/rA:28nCCOOCCCCCCNCCCOCCCCCCClCCCCCC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;w11;s12;d13;s14;s15;s12s16;d17;s18;d19;d16s20;s19;s14;s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H16ClNO3
All Atoms:44
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:12.2737
Area:613.461
Solvation:-3.06282
Coulombic:-33.1599
Bond Count [?]
All:31
Single:19
Double:12
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:389.831
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:5.7
LogP (Chemaxon):6.16

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