1-[(3,5-dimethyl-1-adamantyl)carbonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3,5-dimethyl-1-adamantyl)carbonyl]piperidine-4-carboxylic acid Openeye Name: 1-(3,5-dimethyladamantane-1-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(3,5-dimethyl-1-adamantyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(3,5-dimethyladamantane-1-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(3,5-dimethyladamantane-1-carbonyl)isonipecotic acid Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)C(=O)N4CCC(CC4)C(=O)O)C

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)C(=O)N4CCC(CC4)C(=O)O)C

InChI

InChI=1S/C19H29NO3/c1-17-7-13-8-18(2,10-17)12-19(9-13,11-17)16(23)20-5-3-14(4-6-20)15(21)22/h13-14H,3-12H2,1-2H3,(H,21,22)