(2R)-1-[[(5S,7R)-3-phenyl-1-adamantyl]carbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2R)-1-[[(5S,7R)-3-phenyl-1-adamantyl]carbonyl]pyrrolidine-2-carboxylic acid Openeye Name: (2R)-1-[(5S,7R)-3-phenyladamantane-1-carbonyl]pyrrolidine-2-carboxylic acid CAS Name: (2R)-1-[oxo-[(5S,7R)-3-phenyl-1-adamantyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R)-1-[(5S,7R)-3-phenyladamantane-1-carbonyl]pyrrolidine-2-carboxylic acid Traditional Name: (2R)-1-[(5S,7R)-3-phenyladamantane-1-carbonyl]proline Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)C23C[C@@H]4C[C@H](C2)CC(C4)(C3)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C22H27NO3/c24-19(25)18-7-4-8-23(18)20(26)22-12-15-9-16(13-22)11-21(10-15,14-22)17-5-2-1-3-6-17/h1-3,5-6,15-16,18H,4,7-14H2,(H,24,25)/t15-,16+,18-,21?,22?/m1/s1