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Chemical ID: 4873293
Chemical ID:
4873293
Name [?]:
N-(2,5-dichlorophenyl)-3-hydroxyimino-4,7,7-trimethyl-norbornane-1-carboxamide
SMILES [?]:
CC1(C2(CCC1(CC2=NO)C(=O)Nc3cc(ccc3Cl)Cl)C)C
InChi [?]:
InChI=1/C17H20Cl2N2O2/c1-15(2)16(3)6-7-17(15,9-13(16)21-23)14(22)20-12-8-10(18)4-5-11(12)19/h4-5,8,23H,6-7,9H2,1-3H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,23,22,17,18,4,5,15,7,16,19,14,8,11,2,3,6,21,20,13,9,12,10/E:(1,2)/rA:23cCCCCCCCCNOCONCCCCCCClClCC/rB:s1;s2;s3;s4;s2s5;s6;s3s7;w8;s9;s6;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s16;s3;s2;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H20Cl2N2O2 |
All Atoms: | 23 |
Heavy Atoms: | 23 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 10.6968 |
Area: | 526.407 |
Solvation: | -2.46342 |
Coulombic: | -34.7469 |
Bond Count [?]
All: | 25 |
Single: | 20 |
Double: | 5 |
Rotors: | 3 |
Chiral: | 1 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 355.258 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 3.71 |
LogP (Chemaxon): | 4.5 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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