4-[2-[2-(2-methoxyphenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-yl]ethanoylamino]benzoic acid

Systemtic Name: 4-[2-[2-(2-methoxyphenyl)imino-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-yl]ethanoylamino]benzoic acid Openeye Name: 4-[[2-[3-allyl-2-(2-methoxyphenyl)imino-4-oxo-thiazolidin-5-yl]acetyl]amino]benzoic acid CAS Name: 4-[[2-[2-(2-methoxyphenyl)imino-4-oxo-3-prop-2-enyl-5-thiazolidinyl]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-[2-(2-methoxyphenyl)imino-4-oxo-3-prop-2-enyl-1,3-thiazolidin-5-yl]acetyl]amino]benzoic acid Traditional Name: 4-[[2-[3-allyl-4-keto-2-(2-methoxyphenyl)imino-thiazolidin-5-yl]acetyl]amino]benzoic acid Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N=C2N(C(=O)C(S2)CC(=O)NC3=CC=C(C=C3)C(=O)O)CC=C

Isomeric SMILES

COC1=CC=CC=C1N=C2N(C(=O)C(S2)CC(=O)NC3=CC=C(C=C3)C(=O)O)CC=C

InChI

InChI=1S/C22H21N3O5S/c1-3-12-25-20(27)18(31-22(25)24-16-6-4-5-7-17(16)30-2)13-19(26)23-15-10-8-14(9-11-15)21(28)29/h3-11,18H,1,12-13H2,2H3,(H,23,26)(H,28,29)