Chemical ID: 7628089

CC12CC[N+](C1N(c3c2cc(cc3)OC(=O)NC)C)(C)C
Chemical ID:
7628089
Name [?]:
None
SMILES [?]:
CC12CC[N+](C1N(c3c2cc(cc3)OC(=O)NC)C)(C)C
InChi [?]:
InChI=1/C16H23N3O2/c1-16-8-9-19(4,5)14(16)18(3)13-7-6-11(10-12(13)16)21-15(20)17-2/h6-7,10,14H,8-9H2,1-5H3/p+1
InChi Info:
AuxInfo=1/5/N:1,18,19,20,21,12,13,3,4,10,11,9,8,6,15,2,17,7,5,16,14/E:(4,5)/CRV:19+1,20-1/rA:21cCCCCN+CNCCCCCCOCONCCCC/rB:s1;s2;s3;s4;s2s5;s6;s7;s2s8;d9;s10;d11;d8s12;s11;s14;d15;s15;s17;s7;s5;s5;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H24N3O2+
All Atoms:45
Heavy Atoms:21
Chiral Atoms:None
ZAP Information [?]
Total:-16.7589
Area:460.383
Solvation:-28.2684
Coulombic:-14.9442
Bond Count [?]
All:23
Single:19
Double:4
Rotors:3
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:0.47
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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