sodium (4S)-3-(4-methylphenyl)sulfonyl-2-oxidanylidene-imidazolidine-4-carboxylate

Systemtic Name: sodium (4S)-3-(4-methylphenyl)sulfonyl-2-oxidanylidene-imidazolidine-4-carboxylate Openeye Name: sodium (4S)-2-oxo-3-(p-tolylsulfonyl)imidazolidine-4-carboxylate CAS Name: sodium (4S)-3-(4-methylphenyl)sulfonyl-2-oxo-4-imidazolidinecarboxylate IUPAC Name: sodium (4S)-3-(4-methylphenyl)sulfonyl-2-oxoimidazolidine-4-carboxylate Traditional Name: sodium (4S)-2-keto-3-tosyl-imidazolidine-4-carboxylate Formula: C11H11N2NaO5S MolecularWeight: 306.27021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CNC2=O)C(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](CNC2=O)C(=O)[O-].[Na+]

InChI

InChI=1S/C11H12N2O5S.Na/c1-7-2-4-8(5-3-7)19(17,18)13-9(10(14)15)6-12-11(13)16;/h2-5,9H,6H2,1H3,(H,12,16)(H,14,15);/q;+1/p-1/t9-;/m0./s1