Chemical ID: 6146982

CCc1ccccc1NC(=O)COC(=O)c2ccccc2OC
Chemical ID:
6146982
Name [?]:
(2-ethylphenyl)carbamoylmethyl 2-methoxybenzoate
SMILES [?]:
CCc1ccccc1NC(=O)COC(=O)c2ccccc2OC
InChi [?]:
InChI=1/C18H19NO4/c1-3-13-8-4-6-10-15(13)19-17(20)12-23-18(21)14-9-5-7-11-16(14)22-2/h4-11H,3,12H2,1-2H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,23,2,5,18,6,19,4,17,7,20,12,3,16,8,21,10,14,9,11,15,22,13/rA:23nCCCCCCCCNCOCOCOCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;d14;s14;s16;d17;s18;d19;d16s20;s21;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19NO4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.60114
Area:533.322
Solvation:-4.7319
Coulombic:-48.4741
Bond Count [?]
All:24
Single:16
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:313.348
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.3
LogP (Chemaxon):2.64

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Descriptor Annotations

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