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Chemical ID: 7697906
Chemical ID:
7697906
Name [?]:
None
SMILES [?]:
CCCC(=O)Nc1cccc(c1)C(=O)Nc2ccccc2Cl
InChi [?]:
InChI=1/C17H17ClN2O2/c1-2-6-16(21)19-13-8-5-7-12(11-13)17(22)20-15-10-4-3-9-14(15)18/h3-5,7-11H,2,6H2,1H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,2,19,18,9,3,10,8,20,17,12,11,7,21,16,4,13,22,6,15,5,14/rA:22nCCCCONCCCCCCCONCCCCCCCl/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s11;d13;s13;s15;s16;d17;s18;d19;d16s20;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H17ClN2O2 |
All Atoms: | 39 |
Heavy Atoms: | 22 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 10.3324 |
Area: | 527.595 |
Solvation: | -2.85743 |
Coulombic: | -43.1431 |
Bond Count [?]
All: | 23 |
Single: | 15 |
Double: | 8 |
Rotors: | 7 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.69 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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