[2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 3-oxidanyladamantane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 3-oxidanyladamantane-1-carboxylate Openeye Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid [2-oxo-2-(1-phenylbutylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid [2-keto-2-(1-phenylbutylamino)ethyl] ester Formula: C23H31NO4 MolecularWeight: 385.49654

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)O

InChI

InChI=1S/C23H31NO4/c1-2-6-19(18-7-4-3-5-8-18)24-20(25)14-28-21(26)22-10-16-9-17(11-22)13-23(27,12-16)15-22/h3-5,7-8,16-17,19,27H,2,6,9-15H2,1H3,(H,24,25)