Chemical ID: 6699379

c1ccc2cc(ccc2c1)NC(=O)CCCC(=O)[O-]
Chemical ID:
6699379
Name [?]:
5-(2-naphthylamino)-5-oxo-pentanoate
SMILES [?]:
c1ccc2cc(ccc2c1)NC(=O)CCCC(=O)[O-]
InChi [?]:
InChI=1/C15H15NO3/c17-14(6-3-7-15(18)19)16-13-9-8-11-4-1-2-5-12(11)10-13/h1-2,4-5,8-10H,3,6-7H2,(H,16,17)(H,18,19)/p-1
InChi Info:
AuxInfo=1/1/N:1,2,15,10,3,14,16,8,7,5,9,4,6,12,17,11,13,18,19/E:(18,19)/rA:19nCCCCCCCCCCNCOCCCCOO-/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s6;s11;d12;s12;s14;s15;s16;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14NO3-
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:-33.72
Area:460.007
Solvation:-45.2202
Coulombic:-18.5296
Bond Count [?]
All:20
Single:13
Double:7
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:256.277
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.79
LogP (Chemaxon):2.56

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