(1S,6R)-6-isocyanatocyclohex-3-ene-1-carbonyl chloride

Systemtic Name: (1S,6R)-6-isocyanatocyclohex-3-ene-1-carbonyl chloride Openeye Name: (1S,6R)-6-isocyanatocyclohex-3-ene-1-carbonyl chloride CAS Name: (1S,6R)-6-isocyanato-1-cyclohex-3-enecarbonyl chloride IUPAC Name: (1S,6R)-6-isocyanatocyclohex-3-ene-1-carbonyl chloride Traditional Name: (1S,6R)-6-isocyanatocyclohex-3-ene-1-carbonyl chloride Formula: C8H8ClNO2 MolecularWeight: 185.60762

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)Cl)N=C=O

Isomeric SMILES

C1C=CC[C@H]([C@H]1C(=O)Cl)N=C=O

InChI

InChI=1S/C8H8ClNO2/c9-8(12)6-3-1-2-4-7(6)10-5-11/h1-2,6-7H,3-4H2/t6-,7+/m0/s1