[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] adamantane-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] adamantane-2-carboxylate Openeye Name: [2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-keto-2-[(3,4,5-trimethoxybenzyl)amino]ethyl] ester Formula: C23H31NO6 MolecularWeight: 417.49534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)COC(=O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)COC(=O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C23H31NO6/c1-27-18-9-15(10-19(28-2)22(18)29-3)11-24-20(25)12-30-23(26)21-16-5-13-4-14(7-16)8-17(21)6-13/h9-10,13-14,16-17,21H,4-8,11-12H2,1-3H3,(H,24,25)