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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(=CC1=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC(=O)C1CCC(=CC1=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H25NO3/c1-22-17(21)15-3-2-14(7-16(15)20)19-18-8-11-4-12(9-18)6-13(5-11)10-18/h7,11-13,15,19H,2-6,8-10H2,1H3