Chemical ID: 6387039

CCCOC(=O)c1ccc(cc1)NC(=O)c2cc(ccc2Cl)Cl
Chemical ID:
6387039
Name [?]:
propyl 4-(2,5-dichlorobenzoyl)aminobenzoate
SMILES [?]:
CCCOC(=O)c1ccc(cc1)NC(=O)c2cc(ccc2Cl)Cl
InChi [?]:
InChI=1/C17H15Cl2NO3/c1-2-9-23-17(22)11-3-6-13(7-4-11)20-16(21)14-10-12(18)5-8-15(14)19/h3-8,10H,2,9H2,1H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,2,8,12,19,9,11,20,3,17,7,18,10,16,21,14,5,23,22,13,15,6,4/E:(3,4)(6,7)/rA:23nCCCOCOCCCCCCNCOCCCCCCClCl/rB:s1;s2;s3;s4;d5;s5;s7;d8;s9;d10;d7s11;s10;s13;d14;s14;s16;d17;s18;d19;d16s20;s21;s18;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H15Cl2NO3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:11.2936
Area:567.052
Solvation:-2.88269
Coulombic:-42.6555
Bond Count [?]
All:24
Single:16
Double:8
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:352.211
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.95
LogP (Chemaxon):4.5

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Descriptor Annotations

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