methyl 4-(2-adamantylamino)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 4-(2-adamantylamino)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 4-(2-adamantylamino)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 4-(2-adamantylamino)-2-oxo-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-adamantylamino)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 4-(2-adamantylamino)-2-keto-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C18H25NO3 MolecularWeight: 303.396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(=CC1=O)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

COC(=O)C1CCC(=CC1=O)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C18H25NO3/c1-22-18(21)15-3-2-14(9-16(15)20)19-17-12-5-10-4-11(7-12)8-13(17)6-10/h9-13,15,17,19H,2-8H2,1H3