sodium 4,5,5-trimethyl-4-(phenylcarbamoyl)cyclopentene-1-carboxylate

Systemtic Name: sodium 4,5,5-trimethyl-4-(phenylcarbamoyl)cyclopentene-1-carboxylate Openeye Name: sodium 4,5,5-trimethyl-4-(phenylcarbamoyl)cyclopentene-1-carboxylate CAS Name: sodium 4-[anilino(oxo)methyl]-4,5,5-trimethyl-1-cyclopentenecarboxylate IUPAC Name: sodium 4,5,5-trimethyl-4-(phenylcarbamoyl)cyclopentene-1-carboxylate Traditional Name: sodium 4,5,5-trimethyl-4-(phenylcarbamoyl)cyclopentene-1-carboxylate Formula: C16H18NNaO3 MolecularWeight: 295.30879

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CCC1(C)C(=O)NC2=CC=CC=C2)C(=O)[O-])C.[Na+]

Isomeric SMILES

CC1(C(=CCC1(C)C(=O)NC2=CC=CC=C2)C(=O)[O-])C.[Na+]

InChI

InChI=1S/C16H19NO3.Na/c1-15(2)12(13(18)19)9-10-16(15,3)14(20)17-11-7-5-4-6-8-11;/h4-9H,10H2,1-3H3,(H,17,20)(H,18,19);/q;+1/p-1