4-[[4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 4-[[4-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[(2-amino-4-oxo-5-thiazolylidene)methyl]-2-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-methoxyphenoxy]methyl]benzoic acid Traditional Name: 4-[[4-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic acid Formula: C19H16N2O5S MolecularWeight: 384.40574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)N)OCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)N)OCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H16N2O5S/c1-25-15-8-12(9-16-17(22)21-19(20)27-16)4-7-14(15)26-10-11-2-5-13(6-3-11)18(23)24/h2-9H,10H2,1H3,(H,23,24)(H2,20,21,22)