[2-oxidanylidene-2-(propylamino)ethyl] (5S,7R)-3-phenyladamantane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] (5S,7R)-3-phenyladamantane-1-carboxylate Openeye Name: [2-oxo-2-(propylamino)ethyl] (5S,7R)-3-phenyladamantane-1-carboxylate CAS Name: (5S,7R)-3-phenyl-1-adamantanecarboxylic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] (5S,7R)-3-phenyladamantane-1-carboxylate Traditional Name: (5S,7R)-3-phenyladamantane-1-carboxylic acid [2-keto-2-(propylamino)ethyl] ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C12CC3CC(C1)CC(C3)(C2)C4=CC=CC=C4

Isomeric SMILES

CCCNC(=O)COC(=O)C12C[C@@H]3C[C@H](C1)CC(C3)(C2)C4=CC=CC=C4

InChI

InChI=1S/C22H29NO3/c1-2-8-23-19(24)14-26-20(25)22-12-16-9-17(13-22)11-21(10-16,15-22)18-6-4-3-5-7-18/h3-7,16-17H,2,8-15H2,1H3,(H,23,24)/t16-,17+,21?,22?