[2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] 2,3-dimethoxybenzoate

Systemtic Name: [2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] 2,3-dimethoxybenzoate Openeye Name: [2-(1-adamantylcarbamoylamino)-2-oxo-ethyl] 2,3-dimethoxybenzoate CAS Name: 2,3-dimethoxybenzoic acid [2-[[(1-adamantylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylcarbamoylamino)-2-oxoethyl] 2,3-dimethoxybenzoate Traditional Name: 2,3-dimethoxybenzoic acid [2-(1-adamantylcarbamoylamino)-2-keto-ethyl] ester Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(=O)OCC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC=CC(=C1OC)C(=O)OCC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H28N2O6/c1-28-17-5-3-4-16(19(17)29-2)20(26)30-12-18(25)23-21(27)24-22-9-13-6-14(10-22)8-15(7-13)11-22/h3-5,13-15H,6-12H2,1-2H3,(H2,23,24,25,27)