Chemical ID: 4701362

CCOC(=O)C(=O)Nc1ccccc1C(=O)c2ccccc2
Chemical ID:
4701362
Name [?]:
ethyl 2-(2-benzoylphenyl)amino-2-oxo-acetate
SMILES [?]:
CCOC(=O)C(=O)Nc1ccccc1C(=O)c2ccccc2
InChi [?]:
InChI=1/C17H15NO4/c1-2-22-17(21)16(20)18-14-11-7-6-10-13(14)15(19)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,2,20,19,21,12,11,18,22,13,10,17,14,9,15,6,4,8,16,7,5,3/E:(4,5)(8,9)/rA:22nCCOCOCONCCCCCCCOCCCCCC/rB:s1;s2;s3;d4;s4;d6;s6;s8;s9;d10;s11;d12;d9s13;s14;d15;s15;s17;d18;s19;d20;d17s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H15NO4
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.88031
Area:506.322
Solvation:-2.77773
Coulombic:-55.5654
Bond Count [?]
All:23
Single:14
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:297.305
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.39
LogP (Chemaxon):3.54

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Descriptor Annotations

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