Chemical ID: 6320841

COC(=O)c1ccccc1NC(=O)Cc2ccccc2
Chemical ID:
6320841
Name [?]:
methyl 2-(2-phenylacetyl)aminobenzoate
SMILES [?]:
COC(=O)c1ccccc1NC(=O)Cc2ccccc2
InChi [?]:
InChI=1/C16H15NO3/c1-20-16(19)13-9-5-6-10-14(13)17-15(18)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,18,17,19,7,8,16,20,6,9,14,15,5,10,12,3,11,13,4,2/E:(3,4)(7,8)/rA:20nCOCOCCCCCCNCOCCCCCCC/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H15NO3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.85624
Area:467.967
Solvation:-2.84294
Coulombic:-41.6211
Bond Count [?]
All:21
Single:13
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:269.295
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.17
LogP (Chemaxon):3.42

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Descriptor Annotations

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