sodium (1R,3S)-3-(furan-2-ylmethylcarbamoyl)-1,2,2-trimethyl-cyclopentane-1-carboxylate

Systemtic Name: sodium (1R,3S)-3-(furan-2-ylmethylcarbamoyl)-1,2,2-trimethyl-cyclopentane-1-carboxylate Openeye Name: sodium (1R,3S)-3-(2-furylmethylcarbamoyl)-1,2,2-trimethyl-cyclopentanecarboxylate CAS Name: sodium (1R,3S)-3-[(2-furanylmethylamino)-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylate IUPAC Name: sodium (1R,3S)-3-(furan-2-ylmethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylate Traditional Name: sodium (1R,3S)-3-(2-furfurylcarbamoyl)-1,2,2-trimethyl-cyclopentanecarboxylate Formula: C15H20NNaO4 MolecularWeight: 301.31337

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)[O-])C(=O)NCC2=CC=CO2)C.[Na+]

Isomeric SMILES

C[C@]1(CC[C@@H](C1(C)C)C(=O)NCC2=CC=CO2)C(=O)[O-].[Na+]

InChI

InChI=1S/C15H21NO4.Na/c1-14(2)11(6-7-15(14,3)13(18)19)12(17)16-9-10-5-4-8-20-10;/h4-5,8,11H,6-7,9H2,1-3H3,(H,16,17)(H,18,19);/q;+1/p-1/t11-,15+;/m1./s1