Chemical ID: 6192087

CC(C(=O)O)NC(=O)COc1ccc2ccccc2c1
Chemical ID:
6192087
Name [?]:
2-[2-(2-naphthyloxy)acetyl]aminopropanoic acid
SMILES [?]:
CC(C(=O)O)NC(=O)COc1ccc2ccccc2c1
InChi [?]:
InChI=1/C15H15NO4/c1-10(15(18)19)16-14(17)9-20-13-7-6-11-4-2-3-5-12(11)8-13/h2-8,10H,9H2,1H3,(H,16,17)(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,16,17,15,18,13,12,20,9,2,14,19,11,7,3,6,8,4,5,10/E:(18,19)/rA:20cCCCOONCOCOCCCCCCCCCC/rB:s1;s2;d3;s3;s2;s6;d7;s7;s9;s10;s11;d12;s13;s14;d15;s16;d17;d14s18;d11s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15NO4
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:7.39611
Area:477.636
Solvation:-4.5448
Coulombic:-56.3738
Bond Count [?]
All:21
Single:14
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:273.284
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:2.28
LogP (Chemaxon):1.8

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