cyclohexylazanium; 2-[3-(2,2-dimethoxyethyl)-4-oxidanylidene-2-phenylimino-1,3-thiazolidin-5-yl]ethanoate

Systemtic Name: cyclohexylazanium; 2-[3-(2,2-dimethoxyethyl)-4-oxidanylidene-2-phenylimino-1,3-thiazolidin-5-yl]ethanoate Openeye Name: cyclohexylammonium; 2-[3-(2,2-dimethoxyethyl)-4-oxo-2-phenylimino-thiazolidin-5-yl]acetate CAS Name: cyclohexylammonium; 2-[3-(2,2-dimethoxyethyl)-4-oxo-2-phenylimino-5-thiazolidinyl]acetate IUPAC Name: cyclohexylazanium; 2-[3-(2,2-dimethoxyethyl)-4-oxo-2-phenylimino-1,3-thiazolidin-5-yl]acetate Traditional Name: cyclohexylammonium; 2-[3-(2,2-dimethoxyethyl)-4-keto-2-phenylimino-thiazolidin-5-yl]acetate Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1C(=O)C(SC1=NC2=CC=CC=C2)CC(=O)[O-])OC.C1CCC(CC1)[NH3+]

Isomeric SMILES

COC(CN1C(=O)C(SC1=NC2=CC=CC=C2)CC(=O)[O-])OC.C1CCC(CC1)[NH3+]

InChI

InChI=1S/C15H18N2O5S.C6H13N/c1-21-13(22-2)9-17-14(20)11(8-12(18)19)23-15(17)16-10-6-4-3-5-7-10;7-6-4-2-1-3-5-6/h3-7,11,13H,8-9H2,1-2H3,(H,18,19);6H,1-5,7H2