methyl 4-isocyanocyclohexane-1-carboxylate

Systemtic Name: methyl 4-isocyanocyclohexane-1-carboxylate Openeye Name: methyl 4-isocyanocyclohexanecarboxylate CAS Name: 4-isocyano-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-isocyanocyclohexane-1-carboxylate Traditional Name: 4-isocyanocyclohexanecarboxylic acid methyl ester Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)[N+]#[C-]

Isomeric SMILES

COC(=O)C1CCC(CC1)[N+]#[C-]

InChI

InChI=1S/C9H13NO2/c1-10-8-5-3-7(4-6-8)9(11)12-2/h7-8H,3-6H2,2H3