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CYI

Summary
Name:CYCLOHEXYL ISOCYANIDE
Formula:C7 H11 N
Formal charge:0
Formula weight:109.169 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04cyclohexyl isocyanide
OpenEye OEToolkits1.5.0isocyanocyclohexane

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04isocyanocyclohexane
SMILES_CANONICALCACTVS3.341[C-]#[N+]C1CCCCC1
SMILESCACTVS3.341[C-]#[N+]C1CCCCC1
SMILES_CANONICALOpenEye OEToolkits1.5.0[C-]#[N+]C1CCCCC1
SMILESOpenEye OEToolkits1.5.0[C-]#[N+]C1CCCCC1
InChIInChI1.03InChI=1S/C7H11N/c1-8-7-5-3-2-4-6-7/h7H,2-6H2
InChIKeyInChI1.03XYZMOVWWVXBHDP-UHFFFAOYSA-N

227111

PDB entries from 2024-11-06

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