Chemical ID: 4684453

CCOC(=O)c1ccc(cc1)OCC(=O)Nc2ccccc2
Chemical ID:
4684453
Name [?]:
ethyl 4-(phenylcarbamoylmethoxy)benzoate
SMILES [?]:
CCOC(=O)c1ccc(cc1)OCC(=O)Nc2ccccc2
InChi [?]:
InChI=1/C17H17NO4/c1-2-21-17(20)13-8-10-15(11-9-13)22-12-16(19)18-14-6-4-3-5-7-14/h3-11H,2,12H2,1H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,20,19,21,18,22,7,11,8,10,13,6,17,9,14,4,16,15,5,3,12/E:(4,5)(6,7)(8,9)(10,11)/rA:22nCCOCOCCCCCCOCCONCCCCCC/rB:s1;s2;s3;d4;s4;s6;d7;s8;d9;d6s10;s9;s12;s13;d14;s14;s16;s17;d18;s19;d20;d17s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H17NO4
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.35813
Area:527.733
Solvation:-4.83521
Coulombic:-48.3961
Bond Count [?]
All:23
Single:15
Double:8
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:299.321
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.03
LogP (Chemaxon):2.77

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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