N-[(4-azanyl-4-isocyano-1-phenyl-cyclohexyl)methyl]-2-methoxy-benzamide

Systemtic Name: N-[(4-azanyl-4-isocyano-1-phenyl-cyclohexyl)methyl]-2-methoxy-benzamide Openeye Name: N-[(4-amino-4-isocyano-1-phenyl-cyclohexyl)methyl]-2-methoxy-benzamide CAS Name: N-[(4-amino-4-isocyano-1-phenylcyclohexyl)methyl]-2-methoxybenzamide IUPAC Name: N-[(4-amino-4-isocyano-1-phenylcyclohexyl)methyl]-2-methoxybenzamide Traditional Name: N-[(4-amino-4-isocyano-1-phenyl-cyclohexyl)methyl]-2-methoxy-benzamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCC(CC2)(N)[N+]#[C-])C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCC(CC2)(N)[N+]#[C-])C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2/c1-24-22(23)14-12-21(13-15-22,17-8-4-3-5-9-17)16-25-20(26)18-10-6-7-11-19(18)27-2/h3-11H,12-16,23H2,2H3,(H,25,26)