4-isocyanato-1-methyl-cyclohexane-1-carbaldehyde

Systemtic Name: 4-isocyanato-1-methyl-cyclohexane-1-carbaldehyde Openeye Name: 4-isocyanato-1-methyl-cyclohexanecarbaldehyde CAS Name: 4-isocyanato-1-methyl-1-cyclohexanecarboxaldehyde IUPAC Name: 4-isocyanato-1-methylcyclohexane-1-carbaldehyde Traditional Name: 4-isocyanato-1-methyl-cyclohexanecarbaldehyde Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)N=C=O)C=O

Isomeric SMILES

CC1(CCC(CC1)N=C=O)C=O

InChI

InChI=1S/C9H13NO2/c1-9(6-11)4-2-8(3-5-9)10-7-12/h6,8H,2-5H2,1H3