Chemical ID: 4144470

Cc1cccc(c1C)OCC(=O)Nc2ccccc2C(=O)OC
Chemical ID:
4144470
Name [?]:
methyl 2-[2-(2,3-dimethylphenoxy)acetyl]aminobenzoate
SMILES [?]:
Cc1cccc(c1C)OCC(=O)Nc2ccccc2C(=O)OC
InChi [?]:
InChI=1/C18H19NO4/c1-12-7-6-10-16(13(12)2)23-11-17(20)19-15-9-5-4-8-14(15)18(21)22-3/h4-10H,11H2,1-3H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,8,23,17,16,4,3,18,15,5,10,2,7,19,14,6,11,20,13,12,21,22,9/rA:23nCCCCCCCCOCCONCCCCCCCOOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;d20;s20;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19NO4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.07175
Area:527.243
Solvation:-4.10933
Coulombic:-49.1352
Bond Count [?]
All:24
Single:16
Double:8
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:313.348
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.7
LogP (Chemaxon):4.01

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