Chemical ID: 7090518

COC(=O)C1=NOC2C1CCCCCC2
Chemical ID:
7090518
Name [?]:
methyl 11-oxa-10-azabicyclo[6.3.0]undec-9-ene-9-carboxylate
SMILES [?]:
COC(=O)C1=NOC2C1CCCCCC2
InChi [?]:
InChI=1/C11H17NO3/c1-14-11(13)10-8-6-4-2-3-5-7-9(8)15-12-10/h8-9H,2-7H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,13,11,14,10,15,9,8,5,3,6,4,2,7/rA:15cCOCOCNOCCCCCCCC/rB:s1;s2;d3;s3;d5;s6;s7;s5s8;s9;s10;s11;s12;s13;s8s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H17NO3
All Atoms:32
Heavy Atoms:15
Chiral Atoms:2
ZAP Information [?]
Total:6.71988
Area:375.461
Solvation:-2.66664
Coulombic:-24.9432
Bond Count [?]
All:16
Single:14
Double:2
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:211.258
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:2.79
LogP (Chemaxon):3.05

Name Annotations

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Descriptor Annotations

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