cyclohexylazanium; 2-[2-(4-ethoxycarbonylphenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoate

Systemtic Name: cyclohexylazanium; 2-[2-(4-ethoxycarbonylphenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoate Openeye Name: cyclohexylammonium; 2-[2-(4-ethoxycarbonylphenyl)imino-3-methyl-4-oxo-thiazolidin-5-yl]acetate CAS Name: cyclohexylammonium; 2-[2-(4-ethoxycarbonylphenyl)imino-3-methyl-4-oxo-5-thiazolidinyl]acetate IUPAC Name: cyclohexylazanium; 2-[2-(4-ethoxycarbonylphenyl)imino-3-methyl-4-oxo-1,3-thiazolidin-5-yl]acetate Traditional Name: 2-[2-(4-carbethoxyphenyl)imino-4-keto-3-methyl-thiazolidin-5-yl]acetate; cyclohexylammonium Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)C(S2)CC(=O)[O-])C.C1CCC(CC1)[NH3+]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)C(S2)CC(=O)[O-])C.C1CCC(CC1)[NH3+]

InChI

InChI=1S/C15H16N2O5S.C6H13N/c1-3-22-14(21)9-4-6-10(7-5-9)16-15-17(2)13(20)11(23-15)8-12(18)19;7-6-4-2-1-3-5-6/h4-7,11H,3,8H2,1-2H3,(H,18,19);6H,1-5,7H2