[2-(2-adamantylamino)-2-oxidanylidene-ethyl] 5-methoxy-2-oxidanyl-benzoate

Systemtic Name: [2-(2-adamantylamino)-2-oxidanylidene-ethyl] 5-methoxy-2-oxidanyl-benzoate Openeye Name: [2-(2-adamantylamino)-2-oxo-ethyl] 2-hydroxy-5-methoxy-benzoate CAS Name: 2-hydroxy-5-methoxybenzoic acid [2-(2-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-adamantylamino)-2-oxoethyl] 2-hydroxy-5-methoxybenzoate Traditional Name: 2-hydroxy-5-methoxy-benzoic acid [2-(2-adamantylamino)-2-keto-ethyl] ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C(=O)OCC(=O)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

COC1=CC(=C(C=C1)O)C(=O)OCC(=O)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C20H25NO5/c1-25-15-2-3-17(22)16(9-15)20(24)26-10-18(23)21-19-13-5-11-4-12(7-13)8-14(19)6-11/h2-3,9,11-14,19,22H,4-8,10H2,1H3,(H,21,23)