Chemical ID: 6557857

CCOc1ccc(cc1)C(=O)OCC(=O)Nc2ccc(cc2)C(=O)N
Chemical ID:
6557857
Name [?]:
(4-carbamoylphenyl)carbamoylmethyl 4-ethoxybenzoate
SMILES [?]:
CCOc1ccc(cc1)C(=O)OCC(=O)Nc2ccc(cc2)C(=O)N
InChi [?]:
InChI=1/C18H18N2O5/c1-2-24-15-9-5-13(6-10-15)18(23)25-11-16(21)20-14-7-3-12(4-8-14)17(19)22/h3-10H,2,11H2,1H3,(H2,19,22)(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,2,19,21,6,8,18,22,5,9,13,20,7,17,4,14,23,10,25,16,15,24,11,3,12/E:(3,4)(5,6)(7,8)(9,10)/rA:25nCCOCCCCCCCOOCCONCCCCCCCON/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;d10;s10;s12;s13;d14;s14;s16;s17;d18;s19;d20;d17s21;s20;d23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18N2O5
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.99746
Area:582.184
Solvation:-5.55713
Coulombic:-73.3222
Bond Count [?]
All:26
Single:17
Double:9
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:342.346
H-Bond Donors:3
H-Bond Acceptors:7
XLogP:1.92
LogP (Chemaxon):1.42

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