4-[[4-(8-methoxy-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-[[4-(8-methoxy-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[4-(8-methoxy-2-oxo-chromen-3-yl)thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[4-(8-methoxy-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[4-(8-methoxy-2-oxochromen-3-yl)-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[4-(2-keto-8-methoxy-chromen-3-yl)thiazol-2-yl]amino]benzoic acid Formula: C20H14N2O5S MolecularWeight: 394.40056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C3=CSC(=N3)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C3=CSC(=N3)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C20H14N2O5S/c1-26-16-4-2-3-12-9-14(19(25)27-17(12)16)15-10-28-20(22-15)21-13-7-5-11(6-8-13)18(23)24/h2-10H,1H3,(H,21,22)(H,23,24)