1-(3,5,5-trimethylhexanoylamino)cycloheptane-1-carboxylic acid

Systemtic Name: 1-(3,5,5-trimethylhexanoylamino)cycloheptane-1-carboxylic acid Openeye Name: 1-(3,5,5-trimethylhexanoylamino)cycloheptanecarboxylic acid CAS Name: 1-[(3,5,5-trimethyl-1-oxohexyl)amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-(3,5,5-trimethylhexanoylamino)cycloheptane-1-carboxylic acid Traditional Name: 1-(3,5,5-trimethylhexanoylamino)cycloheptanecarboxylic acid Formula: C17H31NO3 MolecularWeight: 297.43294

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1(CCCCCC1)C(=O)O)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)NC1(CCCCCC1)C(=O)O)CC(C)(C)C

InChI

InChI=1S/C17H31NO3/c1-13(12-16(2,3)4)11-14(19)18-17(15(20)21)9-7-5-6-8-10-17/h13H,5-12H2,1-4H3,(H,18,19)(H,20,21)