sodium 2,3,3-trimethylindole-5-carboxylate

Systemtic Name: sodium 2,3,3-trimethylindole-5-carboxylate Openeye Name: sodium 2,3,3-trimethylindole-5-carboxylate CAS Name: sodium 2,3,3-trimethyl-5-indolecarboxylate IUPAC Name: sodium 2,3,3-trimethylindole-5-carboxylate Traditional Name: sodium 2,3,3-trimethylindole-5-carboxylate Formula: C12H12NNaO2 MolecularWeight: 225.21895

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C1(C)C)C=C(C=C2)C(=O)[O-].[Na+]

Isomeric SMILES

CC1=NC2=C(C1(C)C)C=C(C=C2)C(=O)[O-].[Na+]

InChI

InChI=1S/C12H13NO2.Na/c1-7-12(2,3)9-6-8(11(14)15)4-5-10(9)13-7;/h4-6H,1-3H3,(H,14,15);/q;+1/p-1