Chemical ID: 7116896

c1ccc(cc1)C(c2ccccc2)C(=O)Nc3ccc(cc3)C(=O)[O-]
Chemical ID:
7116896
Name [?]:
4-(2,2-diphenylacetyl)aminobenzoate
SMILES [?]:
c1ccc(cc1)C(c2ccccc2)C(=O)Nc3ccc(cc3)C(=O)[O-]
InChi [?]:
InChI=1/C21H17NO3/c23-20(22-18-13-11-17(12-14-18)21(24)25)19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14,19H,(H,22,23)(H,24,25)/p-1
InChi Info:
AuxInfo=1/1/N:1,11,2,6,10,12,3,5,9,13,19,21,18,22,4,8,20,17,7,14,23,16,15,24,25/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(13,14)(15,16)(24,25)/rA:25nCCCCCCCCCCCCCCONCCCCCCCOO-/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;d11;d8s12;s7;d14;s14;s16;s17;d18;s19;d20;d17s21;s20;d23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H16NO3-
All Atoms:41
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:-31.3343
Area:542.051
Solvation:-44.8855
Coulombic:-23.9894
Bond Count [?]
All:27
Single:16
Double:11
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:330.357
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.61
LogP (Chemaxon):4.51

Name Annotations

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Descriptor Annotations

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