N-[(4-isocyano-4-oxidanyl-1-phenyl-cyclohexyl)methyl]benzamide

Systemtic Name: N-[(4-isocyano-4-oxidanyl-1-phenyl-cyclohexyl)methyl]benzamide Openeye Name: N-[(4-hydroxy-4-isocyano-1-phenyl-cyclohexyl)methyl]benzamide CAS Name: N-[(4-hydroxy-4-isocyano-1-phenylcyclohexyl)methyl]benzamide IUPAC Name: N-[(4-hydroxy-4-isocyano-1-phenylcyclohexyl)methyl]benzamide Traditional Name: N-[(4-hydroxy-4-isocyano-1-phenyl-cyclohexyl)methyl]benzamide Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1(CCC(CC1)(CNC(=O)C2=CC=CC=C2)C3=CC=CC=C3)O

Isomeric SMILES

[C-]#[N+]C1(CCC(CC1)(CNC(=O)C2=CC=CC=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C21H22N2O2/c1-22-21(25)14-12-20(13-15-21,18-10-6-3-7-11-18)16-23-19(24)17-8-4-2-5-9-17/h2-11,25H,12-16H2,(H,23,24)