(2S,4S)-4-(1-adamantyloxy)-1-phenylmethoxycarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-4-(1-adamantyloxy)-1-phenylmethoxycarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-4-(1-adamantyloxy)-1-benzyloxycarbonyl-pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-4-(1-adamantyloxy)-1-phenylmethoxycarbonyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-4-(1-adamantyloxy)-1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-4-(1-adamantyloxy)-1-carbobenzoxy-proline Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OC4CC(N(C4)C(=O)OCC5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1[C@@H](CN([C@@H]1C(=O)O)C(=O)OCC2=CC=CC=C2)OC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29NO5/c25-21(26)20-9-19(13-24(20)22(27)28-14-15-4-2-1-3-5-15)29-23-10-16-6-17(11-23)8-18(7-16)12-23/h1-5,16-20H,6-14H2,(H,25,26)/t16?,17?,18?,19-,20-,23?/m0/s1