4-oxidanylidene-4-[[(1R,5S)-3,3,5-trimethylcyclohexyl]amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[[(1R,5S)-3,3,5-trimethylcyclohexyl]amino]butanoate Openeye Name: 4-oxo-4-[[(1R,5S)-3,3,5-trimethylcyclohexyl]amino]butanoate CAS Name: 4-oxo-4-[[(1R,5S)-3,3,5-trimethylcyclohexyl]amino]butanoate IUPAC Name: 4-oxo-4-[[(1R,5S)-3,3,5-trimethylcyclohexyl]amino]butanoate Traditional Name: 4-keto-4-[[(1R,5S)-3,3,5-trimethylcyclohexyl]amino]butyrate Formula: C13H22NO3- MolecularWeight: 240.31868

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)NC(=O)CCC(=O)[O-]

Isomeric SMILES

C[C@@H]1C[C@H](CC(C1)(C)C)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C13H23NO3/c1-9-6-10(8-13(2,3)7-9)14-11(15)4-5-12(16)17/h9-10H,4-8H2,1-3H3,(H,14,15)(H,16,17)/p-1/t9-,10-/m1/s1