3-(3-acetamido-1-adamantyl)adamantane-1-carboxylic acid

Systemtic Name: 3-(3-acetamido-1-adamantyl)adamantane-1-carboxylic acid Openeye Name: 3-(3-acetamido-1-adamantyl)adamantane-1-carboxylic acid CAS Name: 3-(3-acetamido-1-adamantyl)-1-adamantanecarboxylic acid IUPAC Name: 3-(3-acetamido-1-adamantyl)adamantane-1-carboxylic acid Traditional Name: 3-(3-acetamido-1-adamantyl)adamantane-1-carboxylic acid Formula: C23H33NO3 MolecularWeight: 371.51302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C45CC6CC(C4)CC(C6)(C5)C(=O)O

Isomeric SMILES

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C45CC6CC(C4)CC(C6)(C5)C(=O)O

InChI

InChI=1S/C23H33NO3/c1-14(25)24-23-10-17-3-18(11-23)9-22(8-17,13-23)21-6-15-2-16(7-21)5-20(4-15,12-21)19(26)27/h15-18H,2-13H2,1H3,(H,24,25)(H,26,27)