[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2-(furan-2-carbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2-(furan-2-carbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(2-furoylamino)-4,5-dimethoxy-benzoic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C26H30N2O7 MolecularWeight: 482.5256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NC23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CO5)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NC23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CO5)OC

InChI

InChI=1S/C26H30N2O7/c1-32-21-9-18(19(10-22(21)33-2)27-24(30)20-4-3-5-34-20)25(31)35-14-23(29)28-26-11-15-6-16(12-26)8-17(7-15)13-26/h3-5,9-10,15-17H,6-8,11-14H2,1-2H3,(H,27,30)(H,28,29)