cyclohexylazanium; 2-[2-(4-methoxyphenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-yl]ethanoate

Systemtic Name: cyclohexylazanium; 2-[2-(4-methoxyphenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-yl]ethanoate Openeye Name: 2-[3-allyl-2-(4-methoxyphenyl)imino-4-oxo-thiazolidin-5-yl]acetate; cyclohexylammonium CAS Name: cyclohexylammonium; 2-[2-(4-methoxyphenyl)imino-4-oxo-3-prop-2-enyl-5-thiazolidinyl]acetate IUPAC Name: cyclohexylazanium; 2-[2-(4-methoxyphenyl)imino-4-oxo-3-prop-2-enyl-1,3-thiazolidin-5-yl]acetate Traditional Name: 2-[3-allyl-4-keto-2-(4-methoxyphenyl)imino-thiazolidin-5-yl]acetate; cyclohexylammonium Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C2N(C(=O)C(S2)CC(=O)[O-])CC=C.C1CCC(CC1)[NH3+]

Isomeric SMILES

COC1=CC=C(C=C1)N=C2N(C(=O)C(S2)CC(=O)[O-])CC=C.C1CCC(CC1)[NH3+]

InChI

InChI=1S/C15H16N2O4S.C6H13N/c1-3-8-17-14(20)12(9-13(18)19)22-15(17)16-10-4-6-11(21-2)7-5-10;7-6-4-2-1-3-5-6/h3-7,12H,1,8-9H2,2H3,(H,18,19);6H,1-5,7H2