5-[[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[(5Z)-5-(2H-chromen-3-ylmethylene)-4-oxo-thiazol-2-yl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[(5Z)-5-(2H-1-benzopyran-3-ylmethylidene)-4-oxo-2-thiazolyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxo-1,3-thiazol-2-yl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[(5Z)-5-(2H-chromen-3-ylmethylene)-4-keto-2-thiazolin-2-yl]amino]isophthalic acid Formula: C21H14N2O6S MolecularWeight: 422.41066

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=CC=C2O1)C=C3C(=O)N=C(S3)NC4=CC(=CC(=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1C(=CC2=CC=CC=C2O1)/C=C\3/C(=O)N=C(S3)NC4=CC(=CC(=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C21H14N2O6S/c24-18-17(6-11-5-12-3-1-2-4-16(12)29-10-11)30-21(23-18)22-15-8-13(19(25)26)7-14(9-15)20(27)28/h1-9H,10H2,(H,25,26)(H,27,28)(H,22,23,24)/b17-6-