(5S,7R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)adamantane-1-carboxylic acid

Systemtic Name: (5S,7R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)adamantane-1-carboxylic acid Openeye Name: (5S,7R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)adamantane-1-carboxylic acid CAS Name: (5S,7R)-3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-1-adamantanecarboxylic acid IUPAC Name: (5S,7R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)adamantane-1-carboxylic acid Traditional Name: (5S,7R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)adamantane-1-carboxylic acid Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46)C(=O)O

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46)C(=O)O

InChI

InChI=1S/C26H27NO4/c28-23(29)25-10-16-9-17(11-25)13-26(12-16,15-25)27-24(30)31-14-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-8,16-17,22H,9-15H2,(H,27,30)(H,28,29)/t16-,17+,25?,26?