[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]amino]ethyl] 3-oxidanyladamantane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]amino]ethyl] 3-oxidanyladamantane-1-carboxylate Openeye Name: [2-[(1-benzyl-4-piperidyl)amino]-2-oxo-ethyl] 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid [2-oxo-2-[[1-(phenylmethyl)-4-piperidinyl]amino]ethyl] ester IUPAC Name: [2-[(1-benzylpiperidin-4-yl)amino]-2-oxoethyl] 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid [2-[(1-benzyl-4-piperidyl)amino]-2-keto-ethyl] ester Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)O)CC5=CC=CC=C5

InChI

InChI=1S/C25H34N2O4/c28-22(26-21-6-8-27(9-7-21)15-18-4-2-1-3-5-18)16-31-23(29)24-11-19-10-20(12-24)14-25(30,13-19)17-24/h1-5,19-21,30H,6-17H2,(H,26,28)