Chemical ID: 4298790

COC(=O)c1ccccc1NC(=O)COc2ccccc2
Chemical ID:
4298790
Name [?]:
methyl 2-(2-phenoxyacetyl)aminobenzoate
SMILES [?]:
COC(=O)c1ccccc1NC(=O)COc2ccccc2
InChi [?]:
InChI=1/C16H15NO4/c1-20-16(19)13-9-5-6-10-14(13)17-15(18)11-21-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,19,18,20,7,8,17,21,6,9,14,16,5,10,12,3,11,13,4,2,15/E:(3,4)(7,8)/rA:21nCOCOCCCCCCNCOCOCCCCCC/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s10;s11;d12;s12;s14;s15;s16;d17;s18;d19;d16s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H15NO4
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:7.95023
Area:490.138
Solvation:-4.30322
Coulombic:-49.1632
Bond Count [?]
All:22
Single:14
Double:8
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:285.295
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.04
LogP (Chemaxon):3.07

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Descriptor Annotations

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