[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] adamantane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] adamantane-1-carboxylate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)C12CC3CC(C1)CC(C3)C2)C4=CC=CC=C4

InChI

InChI=1S/C22H29NO3/c1-15(19-5-3-2-4-6-19)13-23-20(24)14-26-21(25)22-10-16-7-17(11-22)9-18(8-16)12-22/h2-6,15-18H,7-14H2,1H3,(H,23,24)/t15-,16?,17?,18?,22?/m1/s1