sodium (2E,4S)-2-(4-butoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-methyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: sodium (2E,4S)-2-(4-butoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-methyl-1,3-thiazolidine-4-carboxylate Openeye Name: sodium (2E,4S)-2-(4-butoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-4-methyl-thiazolidine-4-carboxylate CAS Name: sodium (2E,4S)-2-(4-butoxy-6-oxo-1-cyclohexa-2,4-dienylidene)-4-methyl-4-thiazolidinecarboxylate IUPAC Name: sodium (2E,4S)-2-(4-butoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-4-methyl-1,3-thiazolidine-4-carboxylate Traditional Name: sodium (2E,4S)-2-(4-butoxy-6-keto-cyclohexa-2,4-dien-1-ylidene)-4-methyl-thiazolidine-4-carboxylate Formula: C15H18NNaO4S MolecularWeight: 331.36249

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=O)C(=C2NC(CS2)(C)C(=O)[O-])C=C1.[Na+]

Isomeric SMILES

CCCCOC1=CC(=O)/C(=C/2\N[C@@](CS2)(C)C(=O)[O-])/C=C1.[Na+]

InChI

InChI=1S/C15H19NO4S.Na/c1-3-4-7-20-10-5-6-11(12(17)8-10)13-16-15(2,9-21-13)14(18)19;/h5-6,8,16H,3-4,7,9H2,1-2H3,(H,18,19);/q;+1/p-1/b13-11+;/t15-;/m1./s1