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Chemical ID: 7523596
Chemical ID:
7523596
Name [?]:
N-(3-chlorophenyl)-2-(3-formylphenoxy)-acetamide
SMILES [?]:
c1cc(cc(c1)OCC(=O)Nc2cccc(c2)Cl)C=O
InChi [?]:
InChI=1/C15H12ClNO3/c16-12-4-2-5-13(8-12)17-15(19)10-20-14-6-1-3-11(7-14)9-18/h1-9H,10H2,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,14,2,15,13,6,4,17,19,8,3,16,12,5,9,18,11,20,10,7/rA:20nCCCCCCOCCONCCCCCCClCO/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s16;s3;d19;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H12ClNO3 |
All Atoms: | 32 |
Heavy Atoms: | 20 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 7.08354 |
Area: | 495.625 |
Solvation: | -5.30707 |
Coulombic: | -35.4501 |
Bond Count [?]
All: | 21 |
Single: | 13 |
Double: | 8 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.99 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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