methyl 3-[2-(1-adamantylamino)-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-[2-(1-adamantylamino)-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-[2-(1-adamantylamino)-2-oxo-ethoxy]benzoate CAS Name: 3-[2-(1-adamantylamino)-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(1-adamantylamino)-2-oxoethoxy]benzoate Traditional Name: 3-[2-(1-adamantylamino)-2-keto-ethoxy]benzoic acid methyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OCC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H25NO4/c1-24-19(23)16-3-2-4-17(8-16)25-12-18(22)21-20-9-13-5-14(10-20)7-15(6-13)11-20/h2-4,8,13-15H,5-7,9-12H2,1H3,(H,21,22)