Chemical ID: 7090631

Cc1ccc(cc1)C(C(=O)O)Nc2ccccc2
Chemical ID:
7090631
Name [?]:
2-anilino-2-(p-tolyl)acetic acid
SMILES [?]:
Cc1ccc(cc1)C(C(=O)O)Nc2ccccc2
InChi [?]:
InChI=1/C15H15NO2/c1-11-7-9-12(10-8-11)14(15(17)18)16-13-5-3-2-4-6-13/h2-10,14,16H,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,16,15,17,14,18,3,7,4,6,2,5,13,8,9,12,10,11/E:(3,4)(5,6)(7,8)(9,10)(17,18)/rA:18cCCCCCCCCCOONCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s9;s8;s12;s13;d14;s15;d16;d13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15NO2
All Atoms:33
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:8.47448
Area:435.899
Solvation:-2.42299
Coulombic:-41.6522
Bond Count [?]
All:19
Single:12
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:241.285
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:3.06
LogP (Chemaxon):3.6

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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