[5-(4-hydroxyphenyl)-3-methyl-2-methylidene-4-oxidanylidene-5-propyl-1,3-thiazolidin-3-ium-3-yl] ethanoate

Systemtic Name: [5-(4-hydroxyphenyl)-3-methyl-2-methylidene-4-oxidanylidene-5-propyl-1,3-thiazolidin-3-ium-3-yl] ethanoate Openeye Name: [5-(4-hydroxyphenyl)-3-methyl-2-methylene-4-oxo-5-propyl-thiazolidin-3-ium-3-yl] acetate CAS Name: acetic acid [5-(4-hydroxyphenyl)-3-methyl-2-methylene-4-oxo-5-propyl-3-thiazolidin-3-iumyl] ester IUPAC Name: [5-(4-hydroxyphenyl)-3-methyl-2-methylidene-4-oxo-5-propyl-1,3-thiazolidin-3-ium-3-yl] acetate Traditional Name: acetic acid [5-(4-hydroxyphenyl)-4-keto-3-methyl-2-methylene-5-propyl-thiazolidin-3-ium-3-yl] ester Formula: C16H20NO4S+ MolecularWeight: 322.3993

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)[N+](C(=C)S1)(C)OC(=O)C)C2=CC=C(C=C2)O

Isomeric SMILES

CCCC1(C(=O)[N+](C(=C)S1)(C)OC(=O)C)C2=CC=C(C=C2)O

InChI

InChI=1S/C16H19NO4S/c1-5-10-16(13-6-8-14(19)9-7-13)15(20)17(4,11(2)22-16)21-12(3)18/h6-9H,2,5,10H2,1,3-4H3/p+1