4-[[5-[(4-methoxyphenyl)methyl]-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]amino]benzoic acid

Systemtic Name: 4-[[5-[(4-methoxyphenyl)methyl]-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 4-[[3-allyl-5-[(4-methoxyphenyl)methyl]-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 4-[[5-[(4-methoxyphenyl)methyl]-4-oxo-3-prop-2-enyl-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 4-[[5-[(4-methoxyphenyl)methyl]-4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 4-[(3-allyl-4-keto-5-p-anisyl-thiazolidin-2-ylidene)amino]benzoic acid Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2C(=O)N(C(=NC3=CC=C(C=C3)C(=O)O)S2)CC=C

Isomeric SMILES

COC1=CC=C(C=C1)CC2C(=O)N(C(=NC3=CC=C(C=C3)C(=O)O)S2)CC=C

InChI

InChI=1S/C21H20N2O4S/c1-3-12-23-19(24)18(13-14-4-10-17(27-2)11-5-14)28-21(23)22-16-8-6-15(7-9-16)20(25)26/h3-11,18H,1,12-13H2,2H3,(H,25,26)