(5S,7R)-3-phenyladamantane-1-carboxylic acid

Systemtic Name: (5S,7R)-3-phenyladamantane-1-carboxylic acid Openeye Name: (5S,7R)-3-phenyladamantane-1-carboxylic acid CAS Name: (5S,7R)-3-phenyl-1-adamantanecarboxylic acid IUPAC Name: (5S,7R)-3-phenyladamantane-1-carboxylic acid Traditional Name: (5S,7R)-3-phenyladamantane-1-carboxylic acid Formula: C17H20O2 MolecularWeight: 256.3395

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C17H20O2/c18-15(19)17-9-12-6-13(10-17)8-16(7-12,11-17)14-4-2-1-3-5-14/h1-5,12-13H,6-11H2,(H,18,19)/t12-,13+,16?,17?